2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE) ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM], INNER SALT, MONOSODIUM SALT
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2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE) ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM], INNER SALT, MONOSODIUM SALT
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CAS No:
287183-28-2
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Formula:
C35H38ClN2NaO6S2
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Chemical Name:
2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE) ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM], INNER SALT, MONOSODIUM SALT
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Synonyms:
2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE) ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM], INNER SALT, MONOSODIUM SALT;2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE)ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM, INNER SALT, MONOSODIUM SALT
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CAS No:
2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE) ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM], INNER SALT, MONOSODIUM SALT Basic Attributes
705.26
702.16
DTXSID40701180
Computed Properties
Molecular Weight:703.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:702.1601012
Monoisotopic Mass:702.1601012
Topological Polar Surface Area:138
Heavy Atom Count:47
Complexity:1290
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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2-[2-[2-CHLORO-3-[2-[1,3-DIHYDRO-1-(4-SULFOBUTYL-2H-QUINOLINYLIDENE) ETHYLIDENE]-1-CYCLOPENTENE-1-YL]ETHENYL]-1(4-SULFOBUTYL)QUINOLINIUM], INNER SALT, MONOSODIUM SALT
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