(2S)-2-azanyl-3-[6-oxidanyl-3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]propanoate

Systemtic Name: (2S)-2-azanyl-3-[6-oxidanyl-3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]propanoate Openeye Name: (2S)-2-amino-3-(6-hydroxy-3,4-dioxo-cyclohexa-1,5-dien-1-yl)propanoate CAS Name: (2S)-2-amino-3-(6-hydroxy-3,4-dioxo-1-cyclohexa-1,5-dienyl)propanoate IUPAC Name: (2S)-2-amino-3-(6-hydroxy-3,4-dioxocyclohexa-1,5-dien-1-yl)propanoate Traditional Name: (2S)-2-amino-3-(6-hydroxy-3,4-diketo-cyclohexa-1,5-dien-1-yl)propionate Formula: C9H8NO5- MolecularWeight: 210.16352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO5/c10-5(9(14)15)1-4-2-7(12)8(13)3-6(4)11/h2-3,5,11H,1,10H2,(H,14,15)/p-1/t5-/m0/s1