[1-oxidanyl-1-phosphono-2-(1,2,3,4-tetrahydroquinoxalin-2-yl)ethyl]phosphonic acid

Systemtic Name: [1-oxidanyl-1-phosphono-2-(1,2,3,4-tetrahydroquinoxalin-2-yl)ethyl]phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-2-(1,2,3,4-tetrahydroquinoxalin-2-yl)ethyl]phosphonic acid CAS Name: [1-hydroxy-1-phosphono-2-(1,2,3,4-tetrahydroquinoxalin-2-yl)ethyl]phosphonic acid IUPAC Name: [1-hydroxy-1-phosphono-2-(1,2,3,4-tetrahydroquinoxalin-2-yl)ethyl]phosphonic acid Traditional Name: [1-hydroxy-1-phosphono-2-(1,2,3,4-tetrahydroquinoxalin-2-yl)ethyl]phosphonic acid Formula: C10H16N2O7P2 MolecularWeight: 338.190762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=CC=CC=C2N1)CC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1C(NC2=CC=CC=C2N1)CC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C10H16N2O7P2/c13-10(20(14,15)16,21(17,18)19)5-7-6-11-8-3-1-2-4-9(8)12-7/h1-4,7,11-13H,5-6H2,(H2,14,15,16)(H2,17,18,19)