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

Systemtic Name: methyl 5-[(4-chlorophenyl)carbonyl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-chlorobenzoyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]-(4-methyl-3-nitrophenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-chlorobenzoyl)-(4-methyl-3-nitrophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chlorobenzoyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C25H19ClN2O8S MolecularWeight: 542.94496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H19ClN2O8S/c1-14-4-10-19(13-21(14)28(31)32)37(33,34)27(24(29)16-5-7-17(26)8-6-16)18-9-11-22-20(12-18)23(15(2)36-22)25(30)35-3/h4-13H,1-3H3