[(3S)-1-(cyclobutylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(pyrimidin-4-ylmethyl)azanium

Systemtic Name: [(3S)-1-(cyclobutylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(pyrimidin-4-ylmethyl)azanium Openeye Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-(pyrimidin-4-ylmethyl)ammonium CAS Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl-(4-pyrimidinylmethyl)ammonium IUPAC Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl-(pyrimidin-4-ylmethyl)azanium Traditional Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-keto-3-piperidyl]methyl-(4-pyrimidylmethyl)ammonium Formula: C16H25N4O2+ MolecularWeight: 305.3953

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2CCCC(C2=O)(C[NH2+]CC3=NC=NC=C3)O

Isomeric SMILES

C1CC(C1)CN2CCC[C@@](C2=O)(C[NH2+]CC3=NC=NC=C3)O

InChI

InChI=1S/C16H24N4O2/c21-15-16(22,11-18-9-14-5-7-17-12-19-14)6-2-8-20(15)10-13-3-1-4-13/h5,7,12-13,18,22H,1-4,6,8-11H2/p+1/t16-/m0/s1