(3S)-3-[(4-cyclohexylpiperazin-4-ium-1-yl)methyl]-1-(2,2-dimethylpropyl)-3-oxidanyl-piperidin-2-one

Systemtic Name: (3S)-3-[(4-cyclohexylpiperazin-4-ium-1-yl)methyl]-1-(2,2-dimethylpropyl)-3-oxidanyl-piperidin-2-one Openeye Name: (3S)-3-[(4-cyclohexylpiperazin-4-ium-1-yl)methyl]-1-(2,2-dimethylpropyl)-3-hydroxy-piperidin-2-one CAS Name: (3S)-3-[(4-cyclohexyl-1-piperazin-4-iumyl)methyl]-1-(2,2-dimethylpropyl)-3-hydroxy-2-piperidinone IUPAC Name: (3S)-3-[(4-cyclohexylpiperazin-4-ium-1-yl)methyl]-1-(2,2-dimethylpropyl)-3-hydroxypiperidin-2-one Traditional Name: (3S)-3-[(4-cyclohexylpiperazin-4-ium-1-yl)methyl]-3-hydroxy-1-neopentyl-2-piperidone Formula: C21H40N3O2+ MolecularWeight: 366.5612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCCC(C1=O)(CN2CC[NH+](CC2)C3CCCCC3)O

Isomeric SMILES

CC(C)(C)CN1CCC[C@@](C1=O)(CN2CC[NH+](CC2)C3CCCCC3)O

InChI

InChI=1S/C21H39N3O2/c1-20(2,3)16-24-11-7-10-21(26,19(24)25)17-22-12-14-23(15-13-22)18-8-5-4-6-9-18/h18,26H,4-17H2,1-3H3/p+1/t21-/m0/s1