2-[5-oxidanylidene-2-(phenylmethyl)-1H-pyrazol-4-yl]ethanoate

Systemtic Name: 2-[5-oxidanylidene-2-(phenylmethyl)-1H-pyrazol-4-yl]ethanoate Openeye Name: 2-(2-benzyl-5-oxo-1H-pyrazol-4-yl)acetate CAS Name: 2-[5-oxo-2-(phenylmethyl)-1H-pyrazol-4-yl]acetate IUPAC Name: 2-(2-benzyl-5-oxo-1H-pyrazol-4-yl)acetate Traditional Name: 2-(1-benzyl-3-keto-3-pyrazolin-4-yl)acetate Formula: C12H11N2O3- MolecularWeight: 231.22734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O3/c15-11(16)6-10-8-14(13-12(10)17)7-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,13,17)(H,15,16)/p-1