[(3R)-1-(2,2-dimethylpropyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(3R)-1-(2,2-dimethylpropyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [(3R)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [(3R)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl-methyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(3R)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [(3R)-3-hydroxy-2-keto-1-neopentyl-3-piperidyl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C17H31N4O2+ MolecularWeight: 323.45364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCCC(C1=O)(C[NH+](C)CC2=CN(N=C2)C)O

Isomeric SMILES

CC(C)(C)CN1CCC[C@](C1=O)(C[NH+](C)CC2=CN(N=C2)C)O

InChI

InChI=1S/C17H30N4O2/c1-16(2,3)12-21-8-6-7-17(23,15(21)22)13-19(4)10-14-9-18-20(5)11-14/h9,11,23H,6-8,10,12-13H2,1-5H3/p+1/t17-/m1/s1