4-[4-(1-phenylpiperidin-2-yl)carbonylpiperazin-1-yl]butanoic acid dihydrochloride

Systemtic Name: 4-[4-(1-phenylpiperidin-2-yl)carbonylpiperazin-1-yl]butanoic acid dihydrochloride Openeye Name: 4-[4-(1-phenylpiperidine-2-carbonyl)piperazin-1-yl]butanoic acid dihydrochloride CAS Name: 4-[4-[oxo-(1-phenyl-2-piperidinyl)methyl]-1-piperazinyl]butanoic acid dihydrochloride IUPAC Name: 4-[4-(1-phenylpiperidine-2-carbonyl)piperazin-1-yl]butanoic acid dihydrochloride Traditional Name: 4-[4-(1-phenylpipecoloyl)piperazino]butyric acid dihydrochloride Formula: C20H31Cl2N3O3 MolecularWeight: 432.38444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N2CCN(CC2)CCCC(=O)O)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)N2CCN(CC2)CCCC(=O)O)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C20H29N3O3.2ClH/c24-19(25)10-6-11-21-13-15-22(16-14-21)20(26)18-9-4-5-12-23(18)17-7-2-1-3-8-17;;/h1-3,7-8,18H,4-6,9-16H2,(H,24,25);2*1H