3-[2-[4-(3-methyl-3-oxidanyl-butyl)piperazin-1-yl]-2-phenyl-ethyl]phenol dihydrochloride

Systemtic Name: 3-[2-[4-(3-methyl-3-oxidanyl-butyl)piperazin-1-yl]-2-phenyl-ethyl]phenol dihydrochloride Openeye Name: 3-[2-[4-(3-hydroxy-3-methyl-butyl)piperazin-1-yl]-2-phenyl-ethyl]phenol dihydrochloride CAS Name: 3-[2-[4-(3-hydroxy-3-methylbutyl)-1-piperazinyl]-2-phenylethyl]phenol dihydrochloride IUPAC Name: 3-[2-[4-(3-hydroxy-3-methylbutyl)piperazin-1-yl]-2-phenylethyl]phenol dihydrochloride Traditional Name: 3-[2-[4-(3-hydroxy-3-methyl-butyl)piperazino]-2-phenyl-ethyl]phenol dihydrochloride Formula: C23H34Cl2N2O2 MolecularWeight: 441.43426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1CCN(CC1)C(CC2=CC(=CC=C2)O)C3=CC=CC=C3)O.Cl.Cl

Isomeric SMILES

CC(C)(CCN1CCN(CC1)C(CC2=CC(=CC=C2)O)C3=CC=CC=C3)O.Cl.Cl

InChI

InChI=1S/C23H32N2O2.2ClH/c1-23(2,27)11-12-24-13-15-25(16-14-24)22(20-8-4-3-5-9-20)18-19-7-6-10-21(26)17-19;;/h3-10,17,22,26-27H,11-16,18H2,1-2H3;2*1H