2-azanyl-3-[3-methyl-2-(2-phosphonoethyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-methyl-2-(2-phosphonoethyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[3-methyl-2-(2-phosphonoethyl)phenyl]propanoic acid CAS Name: 2-amino-3-[3-methyl-2-(2-phosphonoethyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-methyl-2-(2-phosphonoethyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[3-methyl-2-(2-phosphonoethyl)phenyl]propionic acid Formula: C12H18NO5P MolecularWeight: 287.248781

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CC(C(=O)O)N)CCP(=O)(O)O

Isomeric SMILES

CC1=C(C(=CC=C1)CC(C(=O)O)N)CCP(=O)(O)O

InChI

InChI=1S/C12H18NO5P/c1-8-3-2-4-9(7-11(13)12(14)15)10(8)5-6-19(16,17)18/h2-4,11H,5-7,13H2,1H3,(H,14,15)(H2,16,17,18)