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

Systemtic Name: methyl-[(2S)-2-oxidanyl-3-(1-oxidanylidenephthalazin-2-yl)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(1-oxophthalazin-2-yl)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(1-oxo-2-phthalazinyl)propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(1-oxophthalazin-2-yl)propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(1-ketophthalazin-2-yl)propyl]-methyl-ammonium Formula: C12H16N3O2+ MolecularWeight: 234.27434

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CN1C(=O)C2=CC=CC=C2C=N1)O

Isomeric SMILES

C[NH2+]C[C@@H](CN1C(=O)C2=CC=CC=C2C=N1)O

InChI

InChI=1S/C12H15N3O2/c1-13-7-10(16)8-15-12(17)11-5-3-2-4-9(11)6-14-15/h2-6,10,13,16H,7-8H2,1H3/p+1/t10-/m0/s1