5-methyl-3-[4-(3-methylbutoxy)phenyl]-1-morpholin-4-yl-2-phenyl-hexan-3-ol hydrochloride

Systemtic Name: 5-methyl-3-[4-(3-methylbutoxy)phenyl]-1-morpholin-4-yl-2-phenyl-hexan-3-ol hydrochloride Openeye Name: 3-(4-isopentyloxyphenyl)-5-methyl-1-morpholino-2-phenyl-hexan-3-ol hydrochloride CAS Name: 5-methyl-3-[4-(3-methylbutoxy)phenyl]-1-(4-morpholinyl)-2-phenyl-3-hexanol hydrochloride IUPAC Name: 5-methyl-3-[4-(3-methylbutoxy)phenyl]-1-morpholin-4-yl-2-phenylhexan-3-ol hydrochloride Traditional Name: 3-(4-isoamoxyphenyl)-5-methyl-1-morpholino-2-phenyl-hexan-3-ol hydrochloride Formula: C28H42ClNO3 MolecularWeight: 476.09098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(CC(C)C)(C(CN2CCOCC2)C3=CC=CC=C3)O.Cl

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(CC(C)C)(C(CN2CCOCC2)C3=CC=CC=C3)O.Cl

InChI

InChI=1S/C28H41NO3.ClH/c1-22(2)14-17-32-26-12-10-25(11-13-26)28(30,20-23(3)4)27(24-8-6-5-7-9-24)21-29-15-18-31-19-16-29;/h5-13,22-23,27,30H,14-21H2,1-4H3;1H