(4-nitrophenyl)methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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(4-nitrophenyl)methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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CAS No:
379732-10-2
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Formula:
C23H20N2O6S
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Chemical Name:
(4-nitrophenyl)methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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Synonyms:
Oprea1_776698;ZINC3228060;AKOS033638169;MCULE-7622663166;Z18715781;(4-nitrophenyl)methyl 3-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzoate;379732-10-2
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CAS No:
(4-nitrophenyl)methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Basic Attributes
452.5 g/mol
452.10420754 g/mol
Computed Properties
Molecular Weight:452.5
XLogP3:3.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:452.10420754
Monoisotopic Mass:452.10420754
Topological Polar Surface Area:118
Heavy Atom Count:32
Complexity:768
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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