[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-thiophen-3-ylpropanoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-thiophen-3-ylpropanoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-thienyl)propionic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H16FNO3S MolecularWeight: 321.366543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)CCC2=CSC=C2)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)CCC2=CSC=C2)F

InChI

InChI=1S/C16H16FNO3S/c17-14-4-1-12(2-5-14)9-18-15(19)10-21-16(20)6-3-13-7-8-22-11-13/h1-2,4-5,7-8,11H,3,6,9-10H2,(H,18,19)