[2-[3-(4-chlorophenyl)pyrrolidin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [2-[3-(4-chlorophenyl)pyrrolidin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [2-[3-(4-chlorophenyl)pyrrolidin-1-yl]-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [2-[3-(4-chlorophenyl)-1-pyrrolidinyl]-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [2-[3-(4-chlorophenyl)pyrrolidin-1-yl]-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [2-[3-(4-chlorophenyl)pyrrolidino]-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C13H20ClNO7P2 MolecularWeight: 399.700922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(O)(P(=O)(O)O)P(=O)(O)O)N1CCC(C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(O)(P(=O)(O)O)P(=O)(O)O)N1CCC(C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H20ClNO7P2/c1-9(13(16,23(17,18)19)24(20,21)22)15-7-6-11(8-15)10-2-4-12(14)5-3-10/h2-5,9,11,16H,6-8H2,1H3,(H2,17,18,19)(H2,20,21,22)