4-[(2-fluorophenyl)-(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(2-fluorophenyl)-(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-fluoro-N-(4-pyridylmethyl)anilino]-4-oxo-butanoate CAS Name: 4-[2-fluoro-N-(pyridin-4-ylmethyl)anilino]-4-oxobutanoate IUPAC Name: 4-[2-fluoro-N-(pyridin-4-ylmethyl)anilino]-4-oxobutanoate Traditional Name: 4-[2-fluoro-N-(4-pyridylmethyl)anilino]-4-keto-butyrate Formula: C16H14FN2O3- MolecularWeight: 301.292363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N(CC2=CC=NC=C2)C(=O)CCC(=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)N(CC2=CC=NC=C2)C(=O)CCC(=O)[O-])F

InChI

InChI=1S/C16H15FN2O3/c17-13-3-1-2-4-14(13)19(15(20)5-6-16(21)22)11-12-7-9-18-10-8-12/h1-4,7-10H,5-6,11H2,(H,21,22)/p-1