1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-7-methoxy-2-methyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-7-methoxy-2-methyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 8-benzyloxy-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinoline CAS Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-2-methyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-2-methyl-8-phenylmethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 8-benzoxy-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinoline Formula: C26H26BrNO4 MolecularWeight: 496.39294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1CC3=CC4=C(C=C3Br)OCO4)C(=C(C=C2)OC)OCC5=CC=CC=C5

Isomeric SMILES

CN1CCC2=C(C1CC3=CC4=C(C=C3Br)OCO4)C(=C(C=C2)OC)OCC5=CC=CC=C5

InChI

InChI=1S/C26H26BrNO4/c1-28-11-10-18-8-9-22(29-2)26(30-15-17-6-4-3-5-7-17)25(18)21(28)12-19-13-23-24(14-20(19)27)32-16-31-23/h3-9,13-14,21H,10-12,15-16H2,1-2H3