6-[(3,4-dimethoxyphenyl)-piperidin-1-yl-methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[(3,4-dimethoxyphenyl)-piperidin-1-yl-methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(3,4-dimethoxyphenyl)-(1-piperidyl)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[(3,4-dimethoxyphenyl)-(1-piperidinyl)methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[(3,4-dimethoxyphenyl)-piperidin-1-ylmethyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(3,4-dimethoxyphenyl)-piperidino-methyl]sesamol Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC3=C(C=C2O)OCO3)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=CC3=C(C=C2O)OCO3)N4CCCCC4)OC

InChI

InChI=1S/C21H25NO5/c1-24-17-7-6-14(10-18(17)25-2)21(22-8-4-3-5-9-22)15-11-19-20(12-16(15)23)27-13-26-19/h6-7,10-12,21,23H,3-5,8-9,13H2,1-2H3