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

Systemtic Name: ethyl 5-[(4-methyl-3-nitro-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-methyl-3-nitro-phenyl)sulfonyl-(pyridine-4-carbonyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(4-methyl-3-nitrophenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methyl-3-nitrophenyl)sulfonyl-(pyridine-4-carbonyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[isonicotinoyl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C30H23N3O8S MolecularWeight: 585.58392

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H23N3O8S/c1-3-40-30(35)27-24-17-22(10-12-26(24)41-28(27)20-7-5-4-6-8-20)32(29(34)21-13-15-31-16-14-21)42(38,39)23-11-9-19(2)25(18-23)33(36)37/h4-18H,3H2,1-2H3