4-[[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]amino]-4-oxo-butanoate CAS Name: 4-[[1-[(3-fluorophenyl)methyl]-3-pyrazolyl]amino]-4-oxobutanoate IUPAC Name: 4-[[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]amino]-4-oxobutanoate Traditional Name: 4-[[1-(3-fluorobenzyl)pyrazol-3-yl]amino]-4-keto-butyrate Formula: C14H13FN3O3- MolecularWeight: 290.269723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CN2C=CC(=N2)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)F)CN2C=CC(=N2)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C14H14FN3O3/c15-11-3-1-2-10(8-11)9-18-7-6-12(17-18)16-13(19)4-5-14(20)21/h1-3,6-8H,4-5,9H2,(H,20,21)(H,16,17,19)/p-1