ethyl 5-[(3-nitrophenyl)carbonyl-(phenylsulfonyl)amino]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(3-nitrophenyl)carbonyl-(phenylsulfonyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[benzenesulfonyl-(3-nitrobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[benzenesulfonyl-[(3-nitrophenyl)-oxomethyl]amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[benzenesulfonyl-(3-nitrobenzoyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[besyl-(3-nitrobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C30H22N2O8S MolecularWeight: 570.56928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H22N2O8S/c1-2-39-30(34)27-25-19-22(16-17-26(25)40-28(27)20-10-5-3-6-11-20)31(41(37,38)24-14-7-4-8-15-24)29(33)21-12-9-13-23(18-21)32(35)36/h3-19H,2H2,1H3