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

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

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

InChI

InChI=1S/C25H19ClN2O8S/c1-3-35-25(30)23-15(2)36-22-12-11-18(14-21(22)23)27(24(29)16-7-9-17(26)10-8-16)37(33,34)20-6-4-5-19(13-20)28(31)32/h4-14H,3H2,1-2H3