[(3S)-1-(2,2-dimethylpropyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1,2-oxazol-3-ylmethyl)azanium

Systemtic Name: [(3S)-1-(2,2-dimethylpropyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1,2-oxazol-3-ylmethyl)azanium Openeye Name: [(3S)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-(isoxazol-3-ylmethyl)ammonium CAS Name: [(3S)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl-(3-isoxazolylmethyl)ammonium IUPAC Name: [(3S)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl-(1,2-oxazol-3-ylmethyl)azanium Traditional Name: [(3S)-3-hydroxy-2-keto-1-neopentyl-3-piperidyl]methyl-(isoxazol-3-ylmethyl)ammonium Formula: C15H26N3O3+ MolecularWeight: 296.38524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCCC(C1=O)(C[NH2+]CC2=NOC=C2)O

Isomeric SMILES

CC(C)(C)CN1CCC[C@@](C1=O)(C[NH2+]CC2=NOC=C2)O

InChI

InChI=1S/C15H25N3O3/c1-14(2,3)11-18-7-4-6-15(20,13(18)19)10-16-9-12-5-8-21-17-12/h5,8,16,20H,4,6-7,9-11H2,1-3H3/p+1/t15-/m0/s1