2-piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate

Systemtic Name: 2-piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate Openeye Name: 2-piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexanecarboxylate CAS Name: 1-cyclohexyl-1-cyclohexanecarboxylic acid 2-(1-piperidin-1-iumyl)ethyl ester IUPAC Name: 2-piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate Traditional Name: 1-cyclohexylcyclohexanecarboxylic acid 2-piperidin-1-ium-1-ylethyl ester Formula: C20H36NO2+ MolecularWeight: 322.50534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2(CCCCC2)C(=O)OCC[NH+]3CCCCC3

Isomeric SMILES

C1CCC(CC1)C2(CCCCC2)C(=O)OCC[NH+]3CCCCC3

InChI

InChI=1S/C20H35NO2/c22-19(23-17-16-21-14-8-3-9-15-21)20(12-6-2-7-13-20)18-10-4-1-5-11-18/h18H,1-17H2/p+1