N-[[(2S,3R)-3-oxidanylbutan-2-yl]amino]-4-oxidanylidene-cyclohexa-2,5-dien-1-imine oxide

Systemtic Name: N-[[(2S,3R)-3-oxidanylbutan-2-yl]amino]-4-oxidanylidene-cyclohexa-2,5-dien-1-imine oxide Openeye Name: N-[[(1S,2R)-2-hydroxy-1-methyl-propyl]amino]-4-oxo-cyclohexa-2,5-dien-1-imine oxide CAS Name: N-[[(2S,3R)-3-hydroxybutan-2-yl]amino]-4-oxo-1-cyclohexa-2,5-dienimine oxide IUPAC Name: N-[[(2S,3R)-3-hydroxybutan-2-yl]amino]-4-oxocyclohexa-2,5-dien-1-imine oxide Traditional Name: N-[[(1S,2R)-2-hydroxy-1-methyl-propyl]amino]-4-keto-cyclohexa-2,5-dien-1-imine oxide Formula: C10H14N2O3 MolecularWeight: 210.22976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)O)N[N+](=C1C=CC(=O)C=C1)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O3/c1-7(8(2)13)11-12(15)9-3-5-10(14)6-4-9/h3-8,11,13H,1-2H3/t7-,8+/m0/s1