(1S)-N-(1-pyridin-1-ium-2-ylpiperidin-4-yl)cyclohex-3-ene-1-carboxamide

Systemtic Name: (1S)-N-(1-pyridin-1-ium-2-ylpiperidin-4-yl)cyclohex-3-ene-1-carboxamide Openeye Name: (1S)-N-(1-pyridin-1-ium-2-yl-4-piperidyl)cyclohex-3-ene-1-carboxamide CAS Name: (1S)-N-[1-(2-pyridin-1-iumyl)-4-piperidinyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1S)-N-(1-pyridin-1-ium-2-ylpiperidin-4-yl)cyclohex-3-ene-1-carboxamide Traditional Name: (1S)-N-(1-pyridin-1-ium-2-yl-4-piperidyl)cyclohex-3-ene-1-carboxamide Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NC2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)NC2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C17H23N3O/c21-17(14-6-2-1-3-7-14)19-15-9-12-20(13-10-15)16-8-4-5-11-18-16/h1-2,4-5,8,11,14-15H,3,6-7,9-10,12-13H2,(H,19,21)/p+1/t14-/m1/s1