[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-methoxybenzoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 3-methoxybenzoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C15H12N2O4S MolecularWeight: 316.33178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C15H12N2O4S/c1-20-12-4-2-3-10(7-12)15(19)21-9-13(18)17-14-11(8-16)5-6-22-14/h2-7H,9H2,1H3,(H,17,18)