1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CC3=CC4=C(C=C3Br)OCO4)OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CC3=CC4=C(C=C3Br)OCO4)OC

InChI

InChI=1S/C19H20BrNO4/c1-22-16-6-11-3-4-21-15(13(11)8-17(16)23-2)5-12-7-18-19(9-14(12)20)25-10-24-18/h6-9,15,21H,3-5,10H2,1-2H3