4-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-1-phenyl-1-pyridin-2-yl-butan-1-ol hydrate hydrochloride

Systemtic Name: 4-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-1-phenyl-1-pyridin-2-yl-butan-1-ol hydrate hydrochloride Openeye Name: 4-[(2R,6S)-2,6-dimethyl-1-piperidyl]-1-phenyl-1-(2-pyridyl)butan-1-ol hydrate hydrochloride CAS Name: 4-[(2R,6S)-2,6-dimethyl-1-piperidinyl]-1-phenyl-1-(2-pyridinyl)-1-butanol hydrate hydrochloride IUPAC Name: 4-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-1-phenyl-1-pyridin-2-ylbutan-1-ol hydrate hydrochloride Traditional Name: 4-[(2R,6S)-2,6-dimethylpiperidino]-1-phenyl-1-(2-pyridyl)butan-1-ol hydrate hydrochloride Formula: C22H33ClN2O2 MolecularWeight: 392.96262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCC(C2=CC=CC=C2)(C3=CC=CC=N3)O)C.O.Cl

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1CCCC(C2=CC=CC=C2)(C3=CC=CC=N3)O)C.O.Cl

InChI

InChI=1S/C22H30N2O.ClH.H2O/c1-18-10-8-11-19(2)24(18)17-9-15-22(25,20-12-4-3-5-13-20)21-14-6-7-16-23-21;;/h3-7,12-14,16,18-19,25H,8-11,15,17H2,1-2H3;1H;1H2/t18-,19+,22?;;