(2,4-dimethylphenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride

Systemtic Name: (2,4-dimethylphenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride Openeye Name: (2,4-dimethylphenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride CAS Name: 1-carbamimidoyl-4-piperidinecarboxylic acid (2,4-dimethylphenyl) ester hydrochloride IUPAC Name: (2,4-dimethylphenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride Traditional Name: 1-amidinoisonipecotic acid (2,4-dimethylphenyl) ester hydrochloride Formula: C15H22ClN3O2 MolecularWeight: 311.80708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2CCN(CC2)C(=N)N)C.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2CCN(CC2)C(=N)N)C.Cl

InChI

InChI=1S/C15H21N3O2.ClH/c1-10-3-4-13(11(2)9-10)20-14(19)12-5-7-18(8-6-12)15(16)17;/h3-4,9,12H,5-8H2,1-2H3,(H3,16,17);1H