(5S)-1-(cyclohexylmethyl)-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazin-1-yl]carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-(cyclohexylmethyl)-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazin-1-yl]carbonyl-piperidin-2-one Openeye Name: (5S)-1-(cyclohexylmethyl)-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazine-1-carbonyl]piperidin-2-one CAS Name: (5S)-1-(cyclohexylmethyl)-5-[[4-(2,6-dimethyl-4-pyridin-1-iumyl)-1-piperazinyl]-oxomethyl]-2-piperidinone IUPAC Name: (5S)-1-(cyclohexylmethyl)-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazine-1-carbonyl]piperidin-2-one Traditional Name: (5S)-1-(cyclohexylmethyl)-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazine-1-carbonyl]-2-piperidone Formula: C24H37N4O2+ MolecularWeight: 413.57618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[NH+]1)C)N2CCN(CC2)C(=O)C3CCC(=O)N(C3)CC4CCCCC4

Isomeric SMILES

CC1=CC(=CC(=[NH+]1)C)N2CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)CC4CCCCC4

InChI

InChI=1S/C24H36N4O2/c1-18-14-22(15-19(2)25-18)26-10-12-27(13-11-26)24(30)21-8-9-23(29)28(17-21)16-20-6-4-3-5-7-20/h14-15,20-21H,3-13,16-17H2,1-2H3/p+1/t21-/m0/s1