2-(1-carbamimidoyl-2-phenyl-piperidin-3-yl)butanoate hydrochloride

Systemtic Name: 2-(1-carbamimidoyl-2-phenyl-piperidin-3-yl)butanoate hydrochloride Openeye Name: 2-(1-carbamimidoyl-2-phenyl-3-piperidyl)butanoate hydrochloride CAS Name: 2-(1-carbamimidoyl-2-phenyl-3-piperidinyl)butanoate hydrochloride IUPAC Name: 2-(1-carbamimidoyl-2-phenylpiperidin-3-yl)butanoate hydrochloride Traditional Name: 2-(1-amidino-2-phenyl-3-piperidyl)butyrate hydrochloride Formula: C16H23ClN3O2- MolecularWeight: 324.82572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCN(C1C2=CC=CC=C2)C(=N)N)C(=O)[O-].Cl

Isomeric SMILES

CCC(C1CCCN(C1C2=CC=CC=C2)C(=N)N)C(=O)[O-].Cl

InChI

InChI=1S/C16H23N3O2.ClH/c1-2-12(15(20)21)13-9-6-10-19(16(17)18)14(13)11-7-4-3-5-8-11;/h3-5,7-8,12-14H,2,6,9-10H2,1H3,(H3,17,18)(H,20,21);1H/p-1