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

Systemtic Name: 4-[[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]amino]-4-oxo-butanoate CAS Name: 4-[[1-[(4-chlorophenyl)methyl]-3-pyrazolyl]amino]-4-oxobutanoate IUPAC Name: 4-[[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]amino]-4-oxobutanoate Traditional Name: 4-[[1-(4-chlorobenzyl)pyrazol-3-yl]amino]-4-keto-butyrate Formula: C14H13ClN3O3- MolecularWeight: 306.72432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC(=N2)NC(=O)CCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC(=N2)NC(=O)CCC(=O)[O-])Cl

InChI

InChI=1S/C14H14ClN3O3/c15-11-3-1-10(2-4-11)9-18-8-7-12(17-18)16-13(19)5-6-14(20)21/h1-4,7-8H,5-6,9H2,(H,20,21)(H,16,17,19)/p-1