ethyl 2-[(3-methoxycarbonyl-5-nitro-phenyl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-methoxycarbonyl-5-nitro-phenyl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-methoxycarbonyl-5-nitro-benzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(3-methoxycarbonyl-5-nitrophenyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-methoxycarbonyl-5-nitrobenzoyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(3-carbomethoxy-5-nitro-benzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H18N2O7S/c1-5-27-18(23)14-9(2)10(3)28-16(14)19-15(21)11-6-12(17(22)26-4)8-13(7-11)20(24)25/h6-8H,5H2,1-4H3,(H,19,21)