butyl 1-carbamimidoyl-3,5-dimethyl-pyrazole-4-carboxylate hydrochloride

Systemtic Name: butyl 1-carbamimidoyl-3,5-dimethyl-pyrazole-4-carboxylate hydrochloride Openeye Name: butyl 1-carbamimidoyl-3,5-dimethyl-pyrazole-4-carboxylate hydrochloride CAS Name: 1-carbamimidoyl-3,5-dimethyl-4-pyrazolecarboxylic acid butyl ester hydrochloride IUPAC Name: butyl 1-carbamimidoyl-3,5-dimethylpyrazole-4-carboxylate hydrochloride Traditional Name: 1-amidino-3,5-dimethyl-pyrazole-4-carboxylic acid butyl ester hydrochloride Formula: C11H19ClN4O2 MolecularWeight: 274.74716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(N(N=C1C)C(=N)N)C.Cl

Isomeric SMILES

CCCCOC(=O)C1=C(N(N=C1C)C(=N)N)C.Cl

InChI

InChI=1S/C11H18N4O2.ClH/c1-4-5-6-17-10(16)9-7(2)14-15(8(9)3)11(12)13;/h4-6H2,1-3H3,(H3,12,13);1H