ethyl 2-[(4-cyanophenyl)carbonylamino]-5-nitro-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-cyanophenyl)carbonylamino]-5-nitro-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-cyanobenzoyl)amino]-5-nitro-thiophene-3-carboxylate CAS Name: 2-[[(4-cyanophenyl)-oxomethyl]amino]-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-cyanobenzoyl)amino]-5-nitrothiophene-3-carboxylate Traditional Name: 2-[(4-cyanobenzoyl)amino]-5-nitro-thiophene-3-carboxylic acid ethyl ester Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O5S/c1-2-23-15(20)11-7-12(18(21)22)24-14(11)17-13(19)10-5-3-9(8-16)4-6-10/h3-7H,2H2,1H3,(H,17,19)