4-[2,2-bis(hydroxymethyl)-5-oxidanylidene-pyrrolidin-1-yl]-3-(oxidanylamino)benzoic acid

Systemtic Name: 4-[2,2-bis(hydroxymethyl)-5-oxidanylidene-pyrrolidin-1-yl]-3-(oxidanylamino)benzoic acid Openeye Name: 4-[2,2-bis(hydroxymethyl)-5-oxo-pyrrolidin-1-yl]-3-(hydroxyamino)benzoic acid CAS Name: 4-[2,2-bis(hydroxymethyl)-5-oxo-1-pyrrolidinyl]-3-(hydroxyamino)benzoic acid IUPAC Name: 4-[2,2-bis(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-(hydroxyamino)benzoic acid Traditional Name: 3-(hydroxyamino)-4-(5-keto-2,2-dimethylol-pyrrolidino)benzoic acid Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1=O)C2=C(C=C(C=C2)C(=O)O)NO)(CO)CO

Isomeric SMILES

C1CC(N(C1=O)C2=C(C=C(C=C2)C(=O)O)NO)(CO)CO

InChI

InChI=1S/C13H16N2O6/c16-6-13(7-17)4-3-11(18)15(13)10-2-1-8(12(19)20)5-9(10)14-21/h1-2,5,14,16-17,21H,3-4,6-7H2,(H,19,20)