1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline

Systemtic Name: 1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline Openeye Name: 7-benzyloxy-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6-methoxy-3,4-dihydroisoquinoline CAS Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline IUPAC Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline Traditional Name: 7-benzoxy-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-6-methoxy-3,4-dihydroisoquinoline Formula: C25H22BrNO4 MolecularWeight: 480.35048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CC3=CC4=C(C=C3Br)OCO4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CC3=CC4=C(C=C3Br)OCO4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H22BrNO4/c1-28-22-10-17-7-8-27-21(9-18-11-23-25(13-20(18)26)31-15-30-23)19(17)12-24(22)29-14-16-5-3-2-4-6-16/h2-6,10-13H,7-9,14-15H2,1H3