[(2S)-1-(1,3-benzoxazol-2-yl)pentan-2-yl]azanium

Systemtic Name: [(2S)-1-(1,3-benzoxazol-2-yl)pentan-2-yl]azanium Openeye Name: [(1S)-1-(1,3-benzoxazol-2-ylmethyl)butyl]ammonium CAS Name: [(2S)-1-(1,3-benzoxazol-2-yl)pentan-2-yl]ammonium IUPAC Name: [(2S)-1-(1,3-benzoxazol-2-yl)pentan-2-yl]azanium Traditional Name: [(1S)-1-(1,3-benzoxazol-2-ylmethyl)butyl]ammonium Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=NC2=CC=CC=C2O1)[NH3+]

Isomeric SMILES

CCC[C@@H](CC1=NC2=CC=CC=C2O1)[NH3+]

InChI

InChI=1S/C12H16N2O/c1-2-5-9(13)8-12-14-10-6-3-4-7-11(10)15-12/h3-4,6-7,9H,2,5,8,13H2,1H3/p+1/t9-/m0/s1