2-azanyl-3-[3-ethenyl-4-(phosphonomethyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-ethenyl-4-(phosphonomethyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(phosphonomethyl)-3-vinyl-phenyl]propanoic acid CAS Name: 2-amino-3-[3-ethenyl-4-(phosphonomethyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-ethenyl-4-(phosphonomethyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[4-(phosphonomethyl)-3-vinyl-phenyl]propionic acid Formula: C12H16NO5P MolecularWeight: 285.232901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16NO5P/c1-2-9-5-8(6-11(13)12(14)15)3-4-10(9)7-19(16,17)18/h2-5,11H,1,6-7,13H2,(H,14,15)(H2,16,17,18)