6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-besyl-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2S(=O)(=O)C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2S(=O)(=O)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H27NO6S/c1-29-19-9-11-20(12-10-19)32-17-23-22-16-25(31-3)24(30-2)15-18(22)13-14-26(23)33(27,28)21-7-5-4-6-8-21/h4-12,15-16,23H,13-14,17H2,1-3H3