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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-piperidin-1-ium-4-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-tert-butylpiperidin-1-ium-4-carboxamide Traditional Name: N-tert-butyl-1-piperonyl-piperidin-1-ium-4-carboxamide Formula: C18H27N2O3+ MolecularWeight: 319.41858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CC[NH+](CC1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)NC(=O)C1CC[NH+](CC1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H26N2O3/c1-18(2,3)19-17(21)14-6-8-20(9-7-14)11-13-4-5-15-16(10-13)23-12-22-15/h4-5,10,14H,6-9,11-12H2,1-3H3,(H,19,21)/p+1