piperidin-2-yl-[2-(trifluoromethyl)phenanthren-9-yl]methanol hydrate hydrochloride

Systemtic Name: piperidin-2-yl-[2-(trifluoromethyl)phenanthren-9-yl]methanol hydrate hydrochloride Openeye Name: 2-piperidyl-[2-(trifluoromethyl)-9-phenanthryl]methanol hydrate hydrochloride CAS Name: 2-piperidinyl-[2-(trifluoromethyl)-9-phenanthrenyl]methanol hydrate hydrochloride IUPAC Name: piperidin-2-yl-[2-(trifluoromethyl)phenanthren-9-yl]methanol hydrate hydrochloride Traditional Name: 2-piperidyl-[2-(trifluoromethyl)-9-phenanthryl]methanol hydrate hydrochloride Formula: C21H23ClF3NO2 MolecularWeight: 413.86103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(C2=CC3=C(C=CC(=C3)C(F)(F)F)C4=CC=CC=C42)O.O.Cl

Isomeric SMILES

C1CCNC(C1)C(C2=CC3=C(C=CC(=C3)C(F)(F)F)C4=CC=CC=C42)O.O.Cl

InChI

InChI=1S/C21H20F3NO.ClH.H2O/c22-21(23,24)14-8-9-15-13(11-14)12-18(17-6-2-1-5-16(15)17)20(26)19-7-3-4-10-25-19;;/h1-2,5-6,8-9,11-12,19-20,25-26H,3-4,7,10H2;1H;1H2