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

Systemtic Name: 6-[(S)-(4-dimethylaminophenyl)-piperidin-1-yl-methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(S)-(4-dimethylaminophenyl)-(1-piperidyl)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[(S)-(4-dimethylaminophenyl)-(1-piperidinyl)methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[(S)-(4-dimethylaminophenyl)-piperidin-1-ylmethyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(S)-(4-dimethylaminophenyl)-piperidino-methyl]sesamol Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC3=C(C=C2O)OCO3)N4CCCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@@H](C2=CC3=C(C=C2O)OCO3)N4CCCCC4

InChI

InChI=1S/C21H26N2O3/c1-22(2)16-8-6-15(7-9-16)21(23-10-4-3-5-11-23)17-12-19-20(13-18(17)24)26-14-25-19/h6-9,12-13,21,24H,3-5,10-11,14H2,1-2H3/t21-/m0/s1