N-(5-bromanyl-2-methoxy-phenyl)sulfonyl-2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanamide

Systemtic Name: N-(5-bromanyl-2-methoxy-phenyl)sulfonyl-2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanamide Openeye Name: N-(5-bromo-2-methoxy-phenyl)sulfonyl-2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetamide CAS Name: N-(5-bromo-2-methoxyphenyl)sulfonyl-2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetamide IUPAC Name: N-(5-bromo-2-methoxyphenyl)sulfonyl-2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetamide Traditional Name: N-(5-bromo-2-methoxy-phenyl)sulfonyl-2-[4-(4,9-diethoxy-3-keto-1H-benz[f]isoindol-2-yl)phenyl]acetamide Formula: C31H29BrN2O7S MolecularWeight: 653.54016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=CC=C(C=C4)CC(=O)NS(=O)(=O)C5=C(C=CC(=C5)Br)OC

Isomeric SMILES

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=CC=C(C=C4)CC(=O)NS(=O)(=O)C5=C(C=CC(=C5)Br)OC

InChI

InChI=1S/C31H29BrN2O7S/c1-4-40-29-22-8-6-7-9-23(22)30(41-5-2)28-24(29)18-34(31(28)36)21-13-10-19(11-14-21)16-27(35)33-42(37,38)26-17-20(32)12-15-25(26)39-3/h6-15,17H,4-5,16,18H2,1-3H3,(H,33,35)