[4-[(4-methoxy-3-nitro-phenyl)sulfonyl-(phenylcarbonyl)amino]naphthalen-1-yl] benzoate

Systemtic Name: [4-[(4-methoxy-3-nitro-phenyl)sulfonyl-(phenylcarbonyl)amino]naphthalen-1-yl] benzoate Openeye Name: [4-[benzoyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]-1-naphthyl] benzoate CAS Name: benzoic acid [4-[benzoyl-(4-methoxy-3-nitrophenyl)sulfonylamino]-1-naphthalenyl] ester IUPAC Name: [4-[benzoyl-(4-methoxy-3-nitrophenyl)sulfonylamino]naphthalen-1-yl] benzoate Traditional Name: benzoic acid [4-[benzoyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]-1-naphthyl] ester Formula: C31H22N2O8S MolecularWeight: 582.57998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H22N2O8S/c1-40-29-18-16-23(20-27(29)33(36)37)42(38,39)32(30(34)21-10-4-2-5-11-21)26-17-19-28(25-15-9-8-14-24(25)26)41-31(35)22-12-6-3-7-13-22/h2-20H,1H3