ethyl 5-[(4-methyl-3-nitro-phenyl)sulfonyl-(4-methylphenyl)carbonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(4-methyl-3-nitro-phenyl)sulfonyl-(4-methylphenyl)carbonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-methylbenzoyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(4-methyl-3-nitrophenyl)sulfonyl-[(4-methylphenyl)-oxomethyl]amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methylbenzoyl)-(4-methyl-3-nitrophenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-methyl-3-nitro-phenyl)sulfonyl-p-toluoyl-amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C32H26N2O8S MolecularWeight: 598.62244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C32H26N2O8S/c1-4-41-32(36)29-26-18-24(15-17-28(26)42-30(29)22-8-6-5-7-9-22)33(31(35)23-13-10-20(2)11-14-23)43(39,40)25-16-12-21(3)27(19-25)34(37)38/h5-19H,4H2,1-3H3