2-azanyl-3-[5-chloranyl-1-(phosphonomethyl)benzimidazol-2-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[5-chloranyl-1-(phosphonomethyl)benzimidazol-2-yl]propanoic acid Openeye Name: 2-amino-3-[5-chloro-1-(phosphonomethyl)benzimidazol-2-yl]propanoic acid CAS Name: 2-amino-3-[5-chloro-1-(phosphonomethyl)-2-benzimidazolyl]propanoic acid IUPAC Name: 2-amino-3-[5-chloro-1-(phosphonomethyl)benzimidazol-2-yl]propanoic acid Traditional Name: 2-amino-3-[5-chloro-1-(phosphonomethyl)benzimidazol-2-yl]propionic acid Formula: C11H13ClN3O5P MolecularWeight: 333.664781

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(N2CP(=O)(O)O)CC(C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(N2CP(=O)(O)O)CC(C(=O)O)N

InChI

InChI=1S/C11H13ClN3O5P/c12-6-1-2-9-8(3-6)14-10(4-7(13)11(16)17)15(9)5-21(18,19)20/h1-3,7H,4-5,13H2,(H,16,17)(H2,18,19,20)