2-[[3-(phosphonomethyl)phenyl]methylamino]propanoic acid

Systemtic Name: 2-[[3-(phosphonomethyl)phenyl]methylamino]propanoic acid Openeye Name: 2-[[3-(phosphonomethyl)phenyl]methylamino]propanoic acid CAS Name: 2-[[3-(phosphonomethyl)phenyl]methylamino]propanoic acid IUPAC Name: 2-[[3-(phosphonomethyl)phenyl]methylamino]propanoic acid Traditional Name: 2-[[3-(phosphonomethyl)benzyl]amino]propionic acid Formula: C11H16NO5P MolecularWeight: 273.222201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC1=CC(=CC=C1)CP(=O)(O)O

Isomeric SMILES

CC(C(=O)O)NCC1=CC(=CC=C1)CP(=O)(O)O

InChI

InChI=1S/C11H16NO5P/c1-8(11(13)14)12-6-9-3-2-4-10(5-9)7-18(15,16)17/h2-5,8,12H,6-7H2,1H3,(H,13,14)(H2,15,16,17)