4-[(3-fluorophenyl)-(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-fluorophenyl)-(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-fluoro-N-(4-pyridylmethyl)anilino]-4-oxo-butanoic acid CAS Name: 4-[3-fluoro-N-(pyridin-4-ylmethyl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[3-fluoro-N-(pyridin-4-ylmethyl)anilino]-4-oxobutanoic acid Traditional Name: 4-[3-fluoro-N-(4-pyridylmethyl)anilino]-4-keto-butyric acid Formula: C16H15FN2O3 MolecularWeight: 302.300303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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