(1R)-2-[(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: (1R)-2-[(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Openeye Name: (1R)-2-[(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline CAS Name: (1R)-2-[(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline IUPAC Name: (1R)-2-[(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Traditional Name: (1R)-2-[(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1CC3=CC4=C(C=C3Br)OCCCO4)OC)OC

Isomeric SMILES

C[C@@H]1C2=CC(=C(C=C2CCN1CC3=CC4=C(C=C3Br)OCCCO4)OC)OC

InChI

InChI=1S/C22H26BrNO4/c1-14-17-11-20(26-3)19(25-2)9-15(17)5-6-24(14)13-16-10-21-22(12-18(16)23)28-8-4-7-27-21/h9-12,14H,4-8,13H2,1-3H3/t14-/m1/s1