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

Systemtic Name: ethyl 5-[(4-chlorophenyl)carbonyl-(2-methyl-5-nitro-phenyl)sulfonyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-chlorobenzoyl)-(2-methyl-5-nitro-phenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]-(2-methyl-5-nitrophenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chlorobenzoyl)-(2-methyl-5-nitrophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chlorobenzoyl)-(2-methyl-5-nitro-phenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C26H21ClN2O8S MolecularWeight: 556.97154

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21ClN2O8S/c1-4-36-26(31)24-16(3)37-22-12-11-19(13-21(22)24)28(25(30)17-6-8-18(27)9-7-17)38(34,35)23-14-20(29(32)33)10-5-15(23)2/h5-14H,4H2,1-3H3