(1R,3R)-1,3-bis(hydroxymethyl)-7-methoxy-6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-8-ol

Systemtic Name: (1R,3R)-1,3-bis(hydroxymethyl)-7-methoxy-6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-8-ol Openeye Name: (1R,3R)-1,3-bis(hydroxymethyl)-7-methoxy-6-methyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-8-ol CAS Name: (1R,3R)-1,3-bis(hydroxymethyl)-7-methoxy-6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-8-ol IUPAC Name: (1R,3R)-1,3-bis(hydroxymethyl)-7-methoxy-6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-8-ol Traditional Name: (1R,3R)-7-methoxy-6-methyl-1,3-dimethylol-2-tosyl-3,4-dihydro-1H-isoquinolin-8-ol Formula: C20H25NO6S MolecularWeight: 407.4806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC3=CC(=C(C(=C3C2CO)O)OC)C)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H](CC3=CC(=C(C(=C3[C@@H]2CO)O)OC)C)CO

InChI

InChI=1S/C20H25NO6S/c1-12-4-6-16(7-5-12)28(25,26)21-15(10-22)9-14-8-13(2)20(27-3)19(24)18(14)17(21)11-23/h4-8,15,17,22-24H,9-11H2,1-3H3/t15-,17+/m1/s1