methyl 5-methyl-5-(phenylmethyl)pyrazole-3-carboxylate

Systemtic Name: methyl 5-methyl-5-(phenylmethyl)pyrazole-3-carboxylate Openeye Name: methyl 5-benzyl-5-methyl-pyrazole-3-carboxylate CAS Name: 5-methyl-5-(phenylmethyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-5-methylpyrazole-3-carboxylate Traditional Name: 5-benzyl-5-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(N=N1)C(=O)OC)CC2=CC=CC=C2

Isomeric SMILES

CC1(C=C(N=N1)C(=O)OC)CC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2/c1-13(8-10-6-4-3-5-7-10)9-11(14-15-13)12(16)17-2/h3-7,9H,8H2,1-2H3