tert-butyl-[5-[7-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)sulfanyl-heptyl]-2-methoxy-phenoxy]-dimethyl-silane

Systemtic Name: tert-butyl-[5-[7-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)sulfanyl-heptyl]-2-methoxy-phenoxy]-dimethyl-silane Openeye Name: tert-butyl-[5-[7-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(p-tolylsulfanyl)heptyl]-2-methoxy-phenoxy]-dimethyl-silane CAS Name: tert-butyl-[5-[7-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[(4-methylphenyl)thio]heptyl]-2-methoxyphenoxy]-dimethylsilane IUPAC Name: tert-butyl-[5-[7-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)sulfanylheptyl]-2-methoxyphenoxy]-dimethylsilane Traditional Name: tert-butyl-[5-[7-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(p-tolylthio)heptyl]-2-methoxy-phenoxy]-dimethyl-silane Formula: C38H55NO4SSi MolecularWeight: 649.9981

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CCCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC(=C(C=C4)OC)O[Si](C)(C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(CCCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC(=C(C=C4)OC)O[Si](C)(C)C(C)(C)C

InChI

InChI=1S/C38H55NO4SSi/c1-28-15-18-32(19-16-28)44-37(30-17-20-33(40-5)36(25-30)43-45(8,9)38(2,3)4)14-12-10-11-13-22-39-23-21-29-24-34(41-6)35(42-7)26-31(29)27-39/h15-20,24-26,37H,10-14,21-23,27H2,1-9H3