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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-cycloheptyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-cycloheptyl-piperidin-1-ium-4-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-cycloheptyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-N-cycloheptylpiperidin-1-ium-4-carboxamide Traditional Name: N-cycloheptyl-1-piperonyl-piperidin-1-ium-4-carboxamide Formula: C21H31N2O3+ MolecularWeight: 359.48244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H30N2O3/c24-21(22-18-5-3-1-2-4-6-18)17-9-11-23(12-10-17)14-16-7-8-19-20(13-16)26-15-25-19/h7-8,13,17-18H,1-6,9-12,14-15H2,(H,22,24)/p+1