4-(3,5-dimethoxyphenyl)carbonyl-N-(3-nitro-5-phenylsulfanyl-phenyl)benzamide

Systemtic Name: 4-(3,5-dimethoxyphenyl)carbonyl-N-(3-nitro-5-phenylsulfanyl-phenyl)benzamide Openeye Name: 4-(3,5-dimethoxybenzoyl)-N-(3-nitro-5-phenylsulfanyl-phenyl)benzamide CAS Name: 4-[(3,5-dimethoxyphenyl)-oxomethyl]-N-[3-nitro-5-(phenylthio)phenyl]benzamide IUPAC Name: 4-(3,5-dimethoxybenzoyl)-N-(3-nitro-5-phenylsulfanylphenyl)benzamide Traditional Name: 4-(3,5-dimethoxybenzoyl)-N-[3-nitro-5-(phenylthio)phenyl]benzamide Formula: C28H22N2O6S MolecularWeight: 514.54908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)C2=CC=C(C=C2)C(=O)NC3=CC(=CC(=C3)SC4=CC=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)C2=CC=C(C=C2)C(=O)NC3=CC(=CC(=C3)SC4=CC=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C28H22N2O6S/c1-35-23-12-20(13-24(17-23)36-2)27(31)18-8-10-19(11-9-18)28(32)29-21-14-22(30(33)34)16-26(15-21)37-25-6-4-3-5-7-25/h3-17H,1-2H3,(H,29,32)