6,7-dimethoxy-2-(3-methyl-4-propan-2-yloxy-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-(3-methyl-4-propan-2-yloxy-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(4-isopropoxy-3-methyl-phenyl)sulfonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-(3-methyl-4-propan-2-yloxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-(3-methyl-4-propan-2-yloxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(4-isopropoxy-3-methyl-phenyl)sulfonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)OC(C)C

InChI

InChI=1S/C21H27NO5S/c1-14(2)27-19-7-6-18(10-15(19)3)28(23,24)22-9-8-16-11-20(25-4)21(26-5)12-17(16)13-22/h6-7,10-12,14H,8-9,13H2,1-5H3