2-[4-[(phenylmethyl)carbamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(phenylmethyl)carbamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(benzylcarbamoyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-[oxo-[(phenylmethyl)amino]methyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(benzylcarbamoyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-(benzylcarbamoyl)pyrazol-1-yl]acetic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)CC(=O)O

InChI

InChI=1S/C13H13N3O3/c17-12(18)9-16-8-11(7-15-16)13(19)14-6-10-4-2-1-3-5-10/h1-5,7-8H,6,9H2,(H,14,19)(H,17,18)