5-oxidanylidene-5-[[1-(phenylmethyl)pyrazol-4-yl]amino]pentanoate

Systemtic Name: 5-oxidanylidene-5-[[1-(phenylmethyl)pyrazol-4-yl]amino]pentanoate Openeye Name: 5-[(1-benzylpyrazol-4-yl)amino]-5-oxo-pentanoate CAS Name: 5-oxo-5-[[1-(phenylmethyl)-4-pyrazolyl]amino]pentanoate IUPAC Name: 5-[(1-benzylpyrazol-4-yl)amino]-5-oxopentanoate Traditional Name: 5-[(1-benzylpyrazol-4-yl)amino]-5-keto-valerate Formula: C15H16N3O3- MolecularWeight: 286.30584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C15H17N3O3/c19-14(7-4-8-15(20)21)17-13-9-16-18(11-13)10-12-5-2-1-3-6-12/h1-3,5-6,9,11H,4,7-8,10H2,(H,17,19)(H,20,21)/p-1