(2R)-2-azanyl-3-[4-chloranyl-1-(diethoxyphosphorylmethyl)benzimidazol-2-yl]propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[4-chloranyl-1-(diethoxyphosphorylmethyl)benzimidazol-2-yl]propanoic acid Openeye Name: (2R)-2-amino-3-[4-chloro-1-(diethoxyphosphorylmethyl)benzimidazol-2-yl]propanoic acid CAS Name: (2R)-2-amino-3-[4-chloro-1-(diethoxyphosphorylmethyl)-2-benzimidazolyl]propanoic acid IUPAC Name: (2R)-2-amino-3-[4-chloro-1-(diethoxyphosphorylmethyl)benzimidazol-2-yl]propanoic acid Traditional Name: (2R)-2-amino-3-[4-chloro-1-(diethoxyphosphorylmethyl)benzimidazol-2-yl]propionic acid Formula: C15H21ClN3O5P MolecularWeight: 389.771101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CN1C2=C(C(=CC=C2)Cl)N=C1CC(C(=O)O)N)OCC

Isomeric SMILES

CCOP(=O)(CN1C2=C(C(=CC=C2)Cl)N=C1C[C@H](C(=O)O)N)OCC

InChI

InChI=1S/C15H21ClN3O5P/c1-3-23-25(22,24-4-2)9-19-12-7-5-6-10(16)14(12)18-13(19)8-11(17)15(20)21/h5-7,11H,3-4,8-9,17H2,1-2H3,(H,20,21)/t11-/m1/s1