(2-methylphenyl) 3-(1-carbamimidoylpiperidin-4-yl)propanoate hydrochloride

Systemtic Name: (2-methylphenyl) 3-(1-carbamimidoylpiperidin-4-yl)propanoate hydrochloride Openeye Name: o-tolyl 3-(1-carbamimidoyl-4-piperidyl)propanoate hydrochloride CAS Name: 3-(1-carbamimidoyl-4-piperidinyl)propanoic acid (2-methylphenyl) ester hydrochloride IUPAC Name: (2-methylphenyl) 3-(1-carbamimidoylpiperidin-4-yl)propanoate hydrochloride Traditional Name: 3-(1-amidino-4-piperidyl)propionic acid o-tolyl ester hydrochloride Formula: C16H24ClN3O2 MolecularWeight: 325.83366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)CCC2CCN(CC2)C(=N)N.Cl

Isomeric SMILES

CC1=CC=CC=C1OC(=O)CCC2CCN(CC2)C(=N)N.Cl

InChI

InChI=1S/C16H23N3O2.ClH/c1-12-4-2-3-5-14(12)21-15(20)7-6-13-8-10-19(11-9-13)16(17)18;/h2-5,13H,6-11H2,1H3,(H3,17,18);1H