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

Systemtic Name: ethyl 5-[(3-nitrophenyl)carbonyl-(2,4,5-trimethylphenyl)sulfonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(3-nitrobenzoyl)-(2,4,5-trimethylphenyl)sulfonyl-amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[[(3-nitrophenyl)-oxomethyl]-(2,4,5-trimethylphenyl)sulfonylamino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-nitrobenzoyl)-(2,4,5-trimethylphenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(3-nitrobenzoyl)-(2,4,5-trimethylphenyl)sulfonyl-amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C33H28N2O8S MolecularWeight: 612.64902

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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=C(C=C(C(=C4)C)C)C)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=C(C=C(C(=C4)C)C)C)C5=CC=CC=C5

InChI

InChI=1S/C33H28N2O8S/c1-5-42-33(37)30-27-19-25(14-15-28(27)43-31(30)23-10-7-6-8-11-23)34(32(36)24-12-9-13-26(18-24)35(38)39)44(40,41)29-17-21(3)20(2)16-22(29)4/h6-19H,5H2,1-4H3