N-[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(1-homoveratryl-4-piperidyl)-piperonylamide Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCC(CC2)NC(=O)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCC(CC2)NC(=O)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C23H28N2O5/c1-27-19-5-3-16(13-21(19)28-2)7-10-25-11-8-18(9-12-25)24-23(26)17-4-6-20-22(14-17)30-15-29-20/h3-6,13-14,18H,7-12,15H2,1-2H3,(H,24,26)