1-(2,2-diphenylethyl)-6,7-dimethoxy-spiro[3H-isoquinoline-4,4'-oxane] hydrochloride

Systemtic Name: 1-(2,2-diphenylethyl)-6,7-dimethoxy-spiro[3H-isoquinoline-4,4'-oxane] hydrochloride Openeye Name: 1-(2,2-diphenylethyl)-6,7-dimethoxy-spiro[3H-isoquinoline-4,4'-tetrahydropyran] hydrochloride CAS Name: 1-(2,2-diphenylethyl)-6,7-dimethoxyspiro[3H-isoquinoline-4,4'-oxane] hydrochloride IUPAC Name: 1-(2,2-diphenylethyl)-6,7-dimethoxyspiro[3H-isoquinoline-4,4'-oxane] hydrochloride Traditional Name: 1-(2,2-diphenylethyl)-6,7-dimethoxy-spiro[3H-isoquinoline-4,4'-tetrahydropyran] hydrochloride Formula: C29H32ClNO3 MolecularWeight: 478.02228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NCC23CCOCC3)CC(C4=CC=CC=C4)C5=CC=CC=C5)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NCC23CCOCC3)CC(C4=CC=CC=C4)C5=CC=CC=C5)OC.Cl

InChI

InChI=1S/C29H31NO3.ClH/c1-31-27-18-24-25(19-28(27)32-2)29(13-15-33-16-14-29)20-30-26(24)17-23(21-9-5-3-6-10-21)22-11-7-4-8-12-22;/h3-12,18-19,23H,13-17,20H2,1-2H3;1H