methyl 4-(2-chlorophenyl)-2-[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)-2-[2-(2-methoxy-5-nitro-phenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(2-chlorophenyl)-2-[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[2-(2-methoxy-5-nitrophenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorophenyl)-2-[[2-(2-methoxy-5-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[[2-(2-methoxy-5-nitro-phenoxy)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H17ClN2O7S MolecularWeight: 476.88688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C21H17ClN2O7S/c1-29-16-8-7-12(24(27)28)9-17(16)31-10-18(25)23-20-19(21(26)30-2)14(11-32-20)13-5-3-4-6-15(13)22/h3-9,11H,10H2,1-2H3,(H,23,25)