2-[[1,2-dihydropyridin-4-ylperoxy(oxidanyl)phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[1,2-dihydropyridin-4-ylperoxy(oxidanyl)phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[1,2-dihydropyridin-4-ylperoxy(hydroxy)phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[1,2-dihydropyridin-4-yldioxy(hydroxy)phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[1,2-dihydropyridin-4-ylperoxy(hydroxy)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[1,2-dihydropyridin-4-ylperoxy(hydroxy)phosphoryl]methyl]glutaric acid Formula: C11H16NO8P MolecularWeight: 321.220401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CN1)OOP(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

C1C=C(C=CN1)OOP(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C11H16NO8P/c13-10(14)2-1-8(11(15)16)7-21(17,18)20-19-9-3-5-12-6-4-9/h3-5,8,12H,1-2,6-7H2,(H,13,14)(H,15,16)(H,17,18)