2-[[5-oxidanyl-2-(4-oxidanylbut-2-ynoylamino)-5-oxidanylidene-pentanoyl]amino]pentanedioic acid

Systemtic Name: 2-[[5-oxidanyl-2-(4-oxidanylbut-2-ynoylamino)-5-oxidanylidene-pentanoyl]amino]pentanedioic acid Openeye Name: 2-[[5-hydroxy-2-(4-hydroxybut-2-ynoylamino)-5-oxo-pentanoyl]amino]pentanedioic acid CAS Name: 2-[[5-hydroxy-2-[(4-hydroxy-1-oxobut-2-ynyl)amino]-1,5-dioxopentyl]amino]pentanedioic acid IUPAC Name: 2-[[5-hydroxy-2-(4-hydroxybut-2-ynoylamino)-5-oxopentanoyl]amino]pentanedioic acid Traditional Name: 2-[[5-hydroxy-2-(4-hydroxybut-2-ynoylamino)-5-keto-pentanoyl]amino]glutaric acid Formula: C14H18N2O9 MolecularWeight: 358.30072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)C#CCO

Isomeric SMILES

C(CC(=O)O)C(C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)C#CCO

InChI

InChI=1S/C14H18N2O9/c17-7-1-2-10(18)15-8(3-5-11(19)20)13(23)16-9(14(24)25)4-6-12(21)22/h8-9,17H,3-7H2,(H,15,18)(H,16,23)(H,19,20)(H,21,22)(H,24,25)