[4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]phenyl]oxidanium

Systemtic Name: [4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]phenyl]oxidanium Openeye Name: [4-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]phenyl]oxonium CAS Name: [4-[(2S)-2-amino-3-hydroxy-3-oxopropyl]phenyl]oxonium IUPAC Name: [4-[(2S)-2-amino-3-hydroxy-3-oxopropyl]phenyl]oxidanium Traditional Name: [4-[(2S)-2-amino-3-hydroxy-3-keto-propyl]phenyl]oxonium Formula: C9H12NO3+ MolecularWeight: 182.19648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)[OH2+]

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)O)N)[OH2+]

InChI

InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/p+1/t8-/m0/s1