1-phenyl-5-(phenylmethyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-phenyl-5-(phenylmethyl)pyrazole-4-carboxylic acid Openeye Name: 5-benzyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 1-phenyl-5-(phenylmethyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-benzyl-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-benzyl-1-phenyl-pyrazole-4-carboxylic acid Formula: C17H14N2O2 MolecularWeight: 278.30526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=NN2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=NN2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H14N2O2/c20-17(21)15-12-18-19(14-9-5-2-6-10-14)16(15)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H,20,21)