(phenylmethyl) 1-carbamimidoyl-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: (phenylmethyl) 1-carbamimidoyl-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: benzyl 1-carbamimidoyl-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-carbamimidoyl-3,5-dimethyl-4-pyrazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-carbamimidoyl-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-amidino-3,5-dimethyl-pyrazole-4-carboxylic acid benzyl ester Formula: C14H16N4O2 MolecularWeight: 272.30244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=N)N)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1C(=N)N)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H16N4O2/c1-9-12(10(2)18(17-9)14(15)16)13(19)20-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H3,15,16)