2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione
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![2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0b39b7e1616147c3b43239102bb2e68b.png "2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione")
2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione
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CAS No:
728921-27-5
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Formula:
C21H14BrN3O6
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Chemical Name:
2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione
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Synonyms:
AKOS034410014;MCULE-2019917626;Z49692017;3-{[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]amino}-8-nitro-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaene-2,4-dione;728921-27-5
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CAS No:
2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-6-nitrobenzo[de]isoquinoline-1,3-dione Basic Attributes
484.3 g/mol
483.00660 g/mol
Computed Properties
Molecular Weight:484.3
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:483.00660
Monoisotopic Mass:483.00660
Topological Polar Surface Area:125
Heavy Atom Count:31
Complexity:758
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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