[2-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [2-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-[5-(2-morpholino-2-oxo-ethyl)-2-thienyl]-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-[5-[2-(4-morpholinyl)-2-oxoethyl]-2-thiophenyl]-2-oxoethyl] ester IUPAC Name: [2-[5-(2-morpholin-4-yl-2-oxoethyl)thiophen-2-yl]-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-2-[5-(2-keto-2-morpholino-ethyl)-2-thienyl]ethyl] ester Formula: C20H18N2O5S MolecularWeight: 398.43232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC2=CC=C(S2)C(=O)COC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1COCCN1C(=O)CC2=CC=C(S2)C(=O)COC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H18N2O5S/c21-12-14-2-1-3-15(10-14)20(25)27-13-17(23)18-5-4-16(28-18)11-19(24)22-6-8-26-9-7-22/h1-5,10H,6-9,11,13H2