2-[5-oxidanylidene-1-(phenylmethyl)-4H-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanylidene-1-(phenylmethyl)-4H-pyrazol-3-yl]ethanoic acid Openeye Name: 2-(1-benzyl-5-oxo-4H-pyrazol-3-yl)acetic acid CAS Name: 2-[5-oxo-1-(phenylmethyl)-4H-pyrazol-3-yl]acetic acid IUPAC Name: 2-(1-benzyl-5-oxo-4H-pyrazol-3-yl)acetic acid Traditional Name: 2-(1-benzyl-5-keto-2-pyrazolin-3-yl)acetic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)CC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

C1C(=NN(C1=O)CC2=CC=CC=C2)CC(=O)O

InChI

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