3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6,7-dimethoxy-3-piperonyl-1,2,3,4-tetrahydroisoquinoline Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CNC(CC2=C1)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2CNC(CC2=C1)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C19H21NO4/c1-21-17-8-13-7-15(20-10-14(13)9-18(17)22-2)5-12-3-4-16-19(6-12)24-11-23-16/h3-4,6,8-9,15,20H,5,7,10-11H2,1-2H3