methyl 4-[(1-carbamimidoyl-3,5-dimethyl-pyrazol-4-yl)methyl]benzoate

Systemtic Name: methyl 4-[(1-carbamimidoyl-3,5-dimethyl-pyrazol-4-yl)methyl]benzoate Openeye Name: methyl 4-[(1-carbamimidoyl-3,5-dimethyl-pyrazol-4-yl)methyl]benzoate CAS Name: 4-[(1-carbamimidoyl-3,5-dimethyl-4-pyrazolyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-carbamimidoyl-3,5-dimethylpyrazol-4-yl)methyl]benzoate Traditional Name: 4-[(1-amidino-3,5-dimethyl-pyrazol-4-yl)methyl]benzoic acid methyl ester Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=N)N)C)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C(=N)N)C)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H18N4O2/c1-9-13(10(2)19(18-9)15(16)17)8-11-4-6-12(7-5-11)14(20)21-3/h4-7H,8H2,1-3H3,(H3,16,17)