methyl-[(2S)-2-oxidanyl-3-(2-oxidanylidenequinoxalin-1-yl)propyl]azanium

Systemtic Name: methyl-[(2S)-2-oxidanyl-3-(2-oxidanylidenequinoxalin-1-yl)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(2-oxoquinoxalin-1-yl)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2-oxo-1-quinoxalinyl)propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(2-oxoquinoxalin-1-yl)propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(2-ketoquinoxalin-1-yl)propyl]-methyl-ammonium Formula: C12H16N3O2+ MolecularWeight: 234.27434

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CN1C2=CC=CC=C2N=CC1=O)O

Isomeric SMILES

C[NH2+]C[C@@H](CN1C2=CC=CC=C2N=CC1=O)O

InChI

InChI=1S/C12H15N3O2/c1-13-6-9(16)8-15-11-5-3-2-4-10(11)14-7-12(15)17/h2-5,7,9,13,16H,6,8H2,1H3/p+1/t9-/m0/s1