N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Traditional Name: N-ethyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)-N-piperonyl-acetamide Formula: C23H27N2O3+ MolecularWeight: 379.47208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C[NH+]3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C[NH+]3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O3/c1-2-25(15-18-8-9-21-22(14-18)28-17-27-21)23(26)16-24-12-10-20(11-13-24)19-6-4-3-5-7-19/h3-10,14H,2,11-13,15-17H2,1H3/p+1