1-[1,3-bis(chloranyl)-6-(trifluoromethyl)phenanthren-9-yl]-2-(dipropylamino)ethanol hydrochloride

Systemtic Name: 1-[1,3-bis(chloranyl)-6-(trifluoromethyl)phenanthren-9-yl]-2-(dipropylamino)ethanol hydrochloride Openeye Name: 1-[1,3-dichloro-6-(trifluoromethyl)-9-phenanthryl]-2-(dipropylamino)ethanol hydrochloride CAS Name: 1-[1,3-dichloro-6-(trifluoromethyl)-9-phenanthrenyl]-2-(dipropylamino)ethanol hydrochloride IUPAC Name: 1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]-2-(dipropylamino)ethanol hydrochloride Traditional Name: 1-[1,3-dichloro-6-(trifluoromethyl)-9-phenanthryl]-2-(dipropylamino)ethanol hydrochloride Formula: C23H25Cl3F3NO MolecularWeight: 494.80491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC(C1=C2C=CC(=CC2=C3C=C(C=C(C3=C1)Cl)Cl)C(F)(F)F)O.Cl

Isomeric SMILES

CCCN(CCC)CC(C1=C2C=CC(=CC2=C3C=C(C=C(C3=C1)Cl)Cl)C(F)(F)F)O.Cl

InChI

InChI=1S/C23H24Cl2F3NO.ClH/c1-3-7-29(8-4-2)13-22(30)20-12-19-18(10-15(24)11-21(19)25)17-9-14(23(26,27)28)5-6-16(17)20;/h5-6,9-12,22,30H,3-4,7-8,13H2,1-2H3;1H