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

Systemtic Name: ethyl 5-[(4-methyl-3-nitro-phenyl)sulfonyl-(4-nitrophenyl)carbonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-methyl-3-nitro-phenyl)sulfonyl-(4-nitrobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(4-methyl-3-nitrophenyl)sulfonyl-[(4-nitrophenyl)-oxomethyl]amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methyl-3-nitrophenyl)sulfonyl-(4-nitrobenzoyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-methyl-3-nitro-phenyl)sulfonyl-(4-nitrobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C31H23N3O10S MolecularWeight: 629.59342

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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(=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)[N+](=O)[O-])S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C31H23N3O10S/c1-3-43-31(36)28-25-17-23(14-16-27(25)44-29(28)20-7-5-4-6-8-20)32(30(35)21-10-12-22(13-11-21)33(37)38)45(41,42)24-15-9-19(2)26(18-24)34(39)40/h4-18H,3H2,1-2H3