[4-[(2-methyl-5-nitro-phenyl)sulfonyl-(4-methylphenyl)carbonyl-amino]naphthalen-1-yl] 4-methylbenzoate

Systemtic Name: [4-[(2-methyl-5-nitro-phenyl)sulfonyl-(4-methylphenyl)carbonyl-amino]naphthalen-1-yl] 4-methylbenzoate Openeye Name: [4-[(4-methylbenzoyl)-(2-methyl-5-nitro-phenyl)sulfonyl-amino]-1-naphthyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(2-methyl-5-nitrophenyl)sulfonyl-[(4-methylphenyl)-oxomethyl]amino]-1-naphthalenyl] ester IUPAC Name: [4-[(4-methylbenzoyl)-(2-methyl-5-nitrophenyl)sulfonylamino]naphthalen-1-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[(2-methyl-5-nitro-phenyl)sulfonyl-p-toluoyl-amino]-1-naphthyl] ester Formula: C33H26N2O7S MolecularWeight: 594.63374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)C)S(=O)(=O)C5=C(C=CC(=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)C)S(=O)(=O)C5=C(C=CC(=C5)[N+](=O)[O-])C

InChI

InChI=1S/C33H26N2O7S/c1-21-8-13-24(14-9-21)32(36)34(43(40,41)31-20-26(35(38)39)17-12-23(31)3)29-18-19-30(28-7-5-4-6-27(28)29)42-33(37)25-15-10-22(2)11-16-25/h4-20H,1-3H3