N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[(3S)-1-(cyclohexylmethyl)-3-piperidin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]isonipecotamide Formula: C20H36N3O2+ MolecularWeight: 350.51874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)NC2CCC[NH+](C2)CC3CCCCC3

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)N[C@H]2CCC[NH+](C2)CC3CCCCC3

InChI

InChI=1S/C20H35N3O2/c1-16(24)23-12-9-18(10-13-23)20(25)21-19-8-5-11-22(15-19)14-17-6-3-2-4-7-17/h17-19H,2-15H2,1H3,(H,21,25)/p+1/t19-/m0/s1