(2S)-2-azanyl-3-(3-azanylidene-6-oxidanyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(3-azanylidene-6-oxidanyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl)propanoic acid Openeye Name: (2S)-2-amino-3-(6-hydroxy-3-imino-4-oxo-cyclohexa-1,5-dien-1-yl)propanoic acid CAS Name: (2S)-2-amino-3-(6-hydroxy-3-imino-4-oxo-1-cyclohexa-1,5-dienyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(6-hydroxy-3-imino-4-oxocyclohexa-1,5-dien-1-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(6-hydroxy-3-imino-4-keto-cyclohexa-1,5-dien-1-yl)propionic acid Formula: C9H10N2O4 MolecularWeight: 210.1867

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=O)C1=N)O)CC(C(=O)O)N

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O4/c10-5-1-4(2-6(11)9(14)15)7(12)3-8(5)13/h1,3,6,10,12H,2,11H2,(H,14,15)/t6-/m0/s1