2-azanyl-3-(4-fluorophenyl)-1-(2-phosphonatopyrrolidin-1-yl)propan-1-one hydrochloride

Systemtic Name: 2-azanyl-3-(4-fluorophenyl)-1-(2-phosphonatopyrrolidin-1-yl)propan-1-one hydrochloride Openeye Name: 2-amino-3-(4-fluorophenyl)-1-(2-phosphonatopyrrolidin-1-yl)propan-1-one hydrochloride CAS Name: 2-amino-3-(4-fluorophenyl)-1-(2-phosphonato-1-pyrrolidinyl)-1-propanone hydrochloride IUPAC Name: 2-amino-3-(4-fluorophenyl)-1-(2-phosphonatopyrrolidin-1-yl)propan-1-one hydrochloride Traditional Name: 2-amino-3-(4-fluorophenyl)-1-(2-phosphonatopyrrolidino)propan-1-one hydrochloride Formula: C13H17ClFN2O4P-2 MolecularWeight: 350.710244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=C(C=C2)F)N)P(=O)([O-])[O-].Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=C(C=C2)F)N)P(=O)([O-])[O-].Cl

InChI

InChI=1S/C13H18FN2O4P.ClH/c14-10-5-3-9(4-6-10)8-11(15)13(17)16-7-1-2-12(16)21(18,19)20;/h3-6,11-12H,1-2,7-8,15H2,(H2,18,19,20);1H/p-2