[7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl] ethanoate

Systemtic Name: [7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl] ethanoate Openeye Name: [8-benzyloxy-7-methoxy-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] acetate CAS Name: acetic acid [7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl] ester IUPAC Name: [7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl] acetate Traditional Name: acetic acid (8-benzoxy-7-methoxy-2-tosyl-3,4-dihydro-1H-isoquinolin-3-yl) ester Formula: C26H27NO6S MolecularWeight: 481.56068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(CC2OC(=O)C)C=CC(=C3OCC4=CC=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(CC2OC(=O)C)C=CC(=C3OCC4=CC=CC=C4)OC

InChI

InChI=1S/C26H27NO6S/c1-18-9-12-22(13-10-18)34(29,30)27-16-23-21(15-25(27)33-19(2)28)11-14-24(31-3)26(23)32-17-20-7-5-4-6-8-20/h4-14,25H,15-17H2,1-3H3