[2-(6-chloranylquinolin-1-ium-1-yl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(6-chloranylquinolin-1-ium-1-yl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(6-chloroquinolin-1-ium-1-yl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(6-chloro-1-quinolin-1-iumyl)-1-hydroxy-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(6-chloroquinolin-1-ium-1-yl)-1-hydroxy-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(6-chloroquinolin-1-ium-1-yl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid Formula: C11H13ClNO7P2+ MolecularWeight: 368.623942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)Cl)[N+](=C1)CC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)Cl)[N+](=C1)CC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C11H12ClNO7P2/c12-9-3-4-10-8(6-9)2-1-5-13(10)7-11(14,21(15,16)17)22(18,19)20/h1-6,14H,7H2,(H3-,15,16,17,18,19,20)/p+1