3-[4-(3-methylbutoxy)phenyl]-1-morpholin-4-yl-2-phenyl-heptan-3-ol hydrochloride

Systemtic Name: 3-[4-(3-methylbutoxy)phenyl]-1-morpholin-4-yl-2-phenyl-heptan-3-ol hydrochloride Openeye Name: 3-(4-isopentyloxyphenyl)-1-morpholino-2-phenyl-heptan-3-ol hydrochloride CAS Name: 3-[4-(3-methylbutoxy)phenyl]-1-(4-morpholinyl)-2-phenyl-3-heptanol hydrochloride IUPAC Name: 3-[4-(3-methylbutoxy)phenyl]-1-morpholin-4-yl-2-phenylheptan-3-ol hydrochloride Traditional Name: 3-(4-isoamoxyphenyl)-1-morpholino-2-phenyl-heptan-3-ol hydrochloride Formula: C28H42ClNO3 MolecularWeight: 476.09098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=C(C=C1)OCCC(C)C)(C(CN2CCOCC2)C3=CC=CC=C3)O.Cl

Isomeric SMILES

CCCCC(C1=CC=C(C=C1)OCCC(C)C)(C(CN2CCOCC2)C3=CC=CC=C3)O.Cl

InChI

InChI=1S/C28H41NO3.ClH/c1-4-5-16-28(30,25-11-13-26(14-12-25)32-19-15-23(2)3)27(24-9-7-6-8-10-24)22-29-17-20-31-21-18-29;/h6-14,23,27,30H,4-5,15-22H2,1-3H3;1H