3-[4,5-dimethoxy-2-[7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl]phenyl]propane-1,2-diol

Systemtic Name: 3-[4,5-dimethoxy-2-[7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl]phenyl]propane-1,2-diol Openeye Name: 3-[2-[8-benzyloxy-7-methoxy-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl]-4,5-dimethoxy-phenyl]propane-1,2-diol CAS Name: 3-[4,5-dimethoxy-2-[7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl]phenyl]propane-1,2-diol IUPAC Name: 3-[4,5-dimethoxy-2-[7-methoxy-2-(4-methylphenyl)sulfonyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinolin-3-yl]phenyl]propane-1,2-diol Traditional Name: 3-[2-(8-benzoxy-7-methoxy-2-tosyl-3,4-dihydro-1H-isoquinolin-3-yl)-4,5-dimethoxy-phenyl]propane-1,2-diol Formula: C35H39NO8S MolecularWeight: 633.75106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(CC2C4=CC(=C(C=C4CC(CO)O)OC)OC)C=CC(=C3OCC5=CC=CC=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(CC2C4=CC(=C(C=C4CC(CO)O)OC)OC)C=CC(=C3OCC5=CC=CC=C5)OC

InChI

InChI=1S/C35H39NO8S/c1-23-10-13-28(14-11-23)45(39,40)36-20-30-25(12-15-32(41-2)35(30)44-22-24-8-6-5-7-9-24)17-31(36)29-19-34(43-4)33(42-3)18-26(29)16-27(38)21-37/h5-15,18-19,27,31,37-38H,16-17,20-22H2,1-4H3