5-(phenylmethyl)-1H-pyrazole-3-carboxylic acid

Systemtic Name: 5-(phenylmethyl)-1H-pyrazole-3-carboxylic acid Openeye Name: 5-benzyl-1H-pyrazole-3-carboxylic acid CAS Name: 5-(phenylmethyl)-1H-pyrazole-3-carboxylic acid IUPAC Name: 5-benzyl-1H-pyrazole-3-carboxylic acid Traditional Name: 5-benzyl-1H-pyrazole-3-carboxylic acid Formula: C11H10N2O2 MolecularWeight: 202.2093

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=NN2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=NN2)C(=O)O

InChI

InChI=1S/C11H10N2O2/c14-11(15)10-7-9(12-13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13)(H,14,15)