methyl 3-[(2-ethanoyl-3-oxidanylidene-but-1-enyl)amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-ethanoyl-3-oxidanylidene-but-1-enyl)amino]thiophene-2-carboxylate Openeye Name: methyl 3-[(2-acetyl-3-oxo-but-1-enyl)amino]thiophene-2-carboxylate CAS Name: 3-[(2-acetyl-3-oxobut-1-enyl)amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-acetyl-3-oxobut-1-enyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(2-acetyl-3-keto-but-1-enyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C12H13NO4S MolecularWeight: 267.30092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC1=C(SC=C1)C(=O)OC)C(=O)C

Isomeric SMILES

CC(=O)C(=CNC1=C(SC=C1)C(=O)OC)C(=O)C

InChI

InChI=1S/C12H13NO4S/c1-7(14)9(8(2)15)6-13-10-4-5-18-11(10)12(16)17-3/h4-6,13H,1-3H3