2-(4-carbamimidoylphenyl)-5-[methyl(piperidin-1-ylcarbonyl)amino]pentanoic acid hydrochloride

Systemtic Name: 2-(4-carbamimidoylphenyl)-5-[methyl(piperidin-1-ylcarbonyl)amino]pentanoic acid hydrochloride Openeye Name: 2-(4-carbamimidoylphenyl)-5-[methyl(piperidine-1-carbonyl)amino]pentanoic acid hydrochloride CAS Name: 2-(4-carbamimidoylphenyl)-5-[methyl-[oxo(1-piperidinyl)methyl]amino]pentanoic acid hydrochloride IUPAC Name: 2-(4-carbamimidoylphenyl)-5-[methyl(piperidine-1-carbonyl)amino]pentanoic acid hydrochloride Traditional Name: 2-(4-amidinophenyl)-5-[methyl(piperidine-1-carbonyl)amino]valeric acid hydrochloride Formula: C19H29ClN4O3 MolecularWeight: 396.91156

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C1=CC=C(C=C1)C(=N)N)C(=O)O)C(=O)N2CCCCC2.Cl

Isomeric SMILES

CN(CCCC(C1=CC=C(C=C1)C(=N)N)C(=O)O)C(=O)N2CCCCC2.Cl

InChI

InChI=1S/C19H28N4O3.ClH/c1-22(19(26)23-12-3-2-4-13-23)11-5-6-16(18(24)25)14-7-9-15(10-8-14)17(20)21;/h7-10,16H,2-6,11-13H2,1H3,(H3,20,21)(H,24,25);1H