3-(1,3-benzodioxol-5-ylmethyl)-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine Traditional Name: 7,8-dimethoxy-3-piperonyl-2,3,4,5-tetrahydro-1H-2-benzazepine Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CNC(CCC2=C1)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2CNC(CCC2=C1)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H23NO4/c1-22-18-9-14-4-5-16(21-11-15(14)10-19(18)23-2)7-13-3-6-17-20(8-13)25-12-24-17/h3,6,8-10,16,21H,4-5,7,11-12H2,1-2H3