ethyl 2-methyl-5-[(4-nitrophenyl)carbonyl-(phenylsulfonyl)amino]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[(4-nitrophenyl)carbonyl-(phenylsulfonyl)amino]-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[benzenesulfonyl-(4-nitrobenzoyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[benzenesulfonyl-[(4-nitrophenyl)-oxomethyl]amino]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[benzenesulfonyl-(4-nitrobenzoyl)amino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[besyl-(4-nitrobenzoyl)amino]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C25H20N2O8S MolecularWeight: 508.4999

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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)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H20N2O8S/c1-3-34-25(29)23-16(2)35-22-14-13-19(15-21(22)23)26(36(32,33)20-7-5-4-6-8-20)24(28)17-9-11-18(12-10-17)27(30)31/h4-15H,3H2,1-2H3