1-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[(2-bromo-3,4-dimethoxy-phenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[(2-bromo-3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[(2-bromo-3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(2-bromo-3,4-dimethoxy-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C20H24BrNO4 MolecularWeight: 422.31286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)Br)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)Br)OC

InChI

InChI=1S/C20H24BrNO4/c1-23-16-6-5-13(19(21)20(16)26-4)9-15-14-11-18(25-3)17(24-2)10-12(14)7-8-22-15/h5-6,10-11,15,22H,7-9H2,1-4H3