1-(1,3-benzodioxol-5-ylmethoxy)-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol Openeye Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol CAS Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propanol IUPAC Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-2-ol Traditional Name: 1-(homoveratrylamino)-3-piperonyloxy-propan-2-ol Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COCC2=CC3=C(C=C2)OCO3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COCC2=CC3=C(C=C2)OCO3)O)OC

InChI

InChI=1S/C21H27NO6/c1-24-18-5-3-15(9-20(18)25-2)7-8-22-11-17(23)13-26-12-16-4-6-19-21(10-16)28-14-27-19/h3-6,9-10,17,22-23H,7-8,11-14H2,1-2H3