6,7-dimethoxy-1-[[(R)-(4-methylphenyl)sulfinyl]methyl]-2-oxidanyl-1-prop-2-enyl-3,4-dihydroisoquinoline

Systemtic Name: 6,7-dimethoxy-1-[[(R)-(4-methylphenyl)sulfinyl]methyl]-2-oxidanyl-1-prop-2-enyl-3,4-dihydroisoquinoline Openeye Name: 1-allyl-2-hydroxy-6,7-dimethoxy-1-[[(R)-p-tolylsulfinyl]methyl]-3,4-dihydroisoquinoline CAS Name: 2-hydroxy-6,7-dimethoxy-1-[[(R)-(4-methylphenyl)sulfinyl]methyl]-1-prop-2-enyl-3,4-dihydroisoquinoline IUPAC Name: 2-hydroxy-6,7-dimethoxy-1-[[(R)-(4-methylphenyl)sulfinyl]methyl]-1-prop-2-enyl-3,4-dihydroisoquinoline Traditional Name: 1-allyl-2-hydroxy-6,7-dimethoxy-1-[[(R)-p-tolylsulfinyl]methyl]-3,4-dihydroisoquinoline Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CC2(C3=CC(=C(C=C3CCN2O)OC)OC)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)CC2(C3=CC(=C(C=C3CCN2O)OC)OC)CC=C

InChI

InChI=1S/C22H27NO4S/c1-5-11-22(15-28(25)18-8-6-16(2)7-9-18)19-14-21(27-4)20(26-3)13-17(19)10-12-23(22)24/h5-9,13-14,24H,1,10-12,15H2,2-4H3/t22?,28-/m1/s1