ethyl 4-[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(cyclohexylmethyl)piperidin-1-ium-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(cyclohexylmethyl)-4-piperidin-1-iumyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(cyclohexylmethyl)piperidin-1-ium-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(cyclohexylmethyl)piperidin-1-ium-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H36N3O3+ MolecularWeight: 366.51814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CC[NH+](CC2)CC3CCCCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CC[NH+](CC2)CC3CCCCC3

InChI

InChI=1S/C20H35N3O3/c1-2-26-20(25)23-14-12-22(13-15-23)19(24)18-8-10-21(11-9-18)16-17-6-4-3-5-7-17/h17-18H,2-16H2,1H3/p+1