[(2S)-3,3-dimethyl-1-(2-oxidanylidene-1,3-benzoxazol-3-yl)butan-2-yl]azanium

Systemtic Name: [(2S)-3,3-dimethyl-1-(2-oxidanylidene-1,3-benzoxazol-3-yl)butan-2-yl]azanium Openeye Name: [(1S)-2,2-dimethyl-1-[(2-oxo-1,3-benzoxazol-3-yl)methyl]propyl]ammonium CAS Name: [(2S)-3,3-dimethyl-1-(2-oxo-1,3-benzoxazol-3-yl)butan-2-yl]ammonium IUPAC Name: [(2S)-3,3-dimethyl-1-(2-oxo-1,3-benzoxazol-3-yl)butan-2-yl]azanium Traditional Name: [(1S)-1-[(2-keto-1,3-benzoxazol-3-yl)methyl]-2,2-dimethyl-propyl]ammonium Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C2=CC=CC=C2OC1=O)[NH3+]

Isomeric SMILES

CC(C)(C)[C@@H](CN1C2=CC=CC=C2OC1=O)[NH3+]

InChI

InChI=1S/C13H18N2O2/c1-13(2,3)11(14)8-15-9-6-4-5-7-10(9)17-12(15)16/h4-7,11H,8,14H2,1-3H3/p+1/t11-/m1/s1