methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-4-(4-methoxyphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-4-(4-methoxyphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-chloro-3-nitro-benzoyl)amino]-4-(4-methoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-4-(4-methoxyphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-3-nitrobenzoyl)amino]-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]-4-(4-methoxyphenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H17ClN2O6S MolecularWeight: 460.88748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H17ClN2O6S/c1-11-17(12-4-7-14(29-2)8-5-12)18(21(26)30-3)20(31-11)23-19(25)13-6-9-15(22)16(10-13)24(27)28/h4-10H,1-3H3,(H,23,25)