(2S,3R)-2,3-bis(oxidanyl)-4-oxidanylidene-4-(quinolin-5-ylamino)butanoic acid

Systemtic Name: (2S,3R)-2,3-bis(oxidanyl)-4-oxidanylidene-4-(quinolin-5-ylamino)butanoic acid Openeye Name: (2S,3R)-2,3-dihydroxy-4-oxo-4-(5-quinolylamino)butanoic acid CAS Name: (2S,3R)-2,3-dihydroxy-4-oxo-4-(5-quinolinylamino)butanoic acid IUPAC Name: (2S,3R)-2,3-dihydroxy-4-oxo-4-(quinolin-5-ylamino)butanoic acid Traditional Name: (2S,3R)-2,3-dihydroxy-4-keto-4-(5-quinolylamino)butyric acid Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)C(C(C(=O)O)O)O

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)[C@@H]([C@@H](C(=O)O)O)O

InChI

InChI=1S/C13H12N2O5/c16-10(11(17)13(19)20)12(18)15-9-5-1-4-8-7(9)3-2-6-14-8/h1-6,10-11,16-17H,(H,15,18)(H,19,20)/t10-,11+/m1/s1