(4-methylphenyl) 4-(1-carbamimidoylpiperidin-3-yl)butanoate hydrochloride

Systemtic Name: (4-methylphenyl) 4-(1-carbamimidoylpiperidin-3-yl)butanoate hydrochloride Openeye Name: p-tolyl 4-(1-carbamimidoyl-3-piperidyl)butanoate hydrochloride CAS Name: 4-(1-carbamimidoyl-3-piperidinyl)butanoic acid (4-methylphenyl) ester hydrochloride IUPAC Name: (4-methylphenyl) 4-(1-carbamimidoylpiperidin-3-yl)butanoate hydrochloride Traditional Name: 4-(1-amidino-3-piperidyl)butyric acid p-tolyl ester hydrochloride Formula: C17H26ClN3O2 MolecularWeight: 339.86024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)CCCC2CCCN(C2)C(=N)N.Cl

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)CCCC2CCCN(C2)C(=N)N.Cl

InChI

InChI=1S/C17H25N3O2.ClH/c1-13-7-9-15(10-8-13)22-16(21)6-2-4-14-5-3-11-20(12-14)17(18)19;/h7-10,14H,2-6,11-12H2,1H3,(H3,18,19);1H