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

Systemtic Name: ethyl 5-[(4-chlorophenyl)carbonyl-(phenylsulfonyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[benzenesulfonyl-(4-chlorobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[benzenesulfonyl-[(4-chlorophenyl)-oxomethyl]amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[benzenesulfonyl-(4-chlorobenzoyl)amino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[besyl-(4-chlorobenzoyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C30H22ClNO6S MolecularWeight: 560.01678

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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)Cl)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=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H22ClNO6S/c1-2-37-30(34)27-25-19-23(17-18-26(25)38-28(27)20-9-5-3-6-10-20)32(29(33)21-13-15-22(31)16-14-21)39(35,36)24-11-7-4-8-12-24/h3-19H,2H2,1H3