1-(1,3-benzodioxol-5-ylmethyl)-N-phenethyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-phenethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: N-phenethyl-1-piperonyl-piperidin-1-ium-4-carboxamide Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O3/c25-22(23-11-8-17-4-2-1-3-5-17)19-9-12-24(13-10-19)15-18-6-7-20-21(14-18)27-16-26-20/h1-7,14,19H,8-13,15-16H2,(H,23,25)/p+1