2-azanyl-3-[2-(phosphonomethyl)quinolin-3-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(phosphonomethyl)quinolin-3-yl]propanoic acid Openeye Name: 2-amino-3-[2-(phosphonomethyl)-3-quinolyl]propanoic acid CAS Name: 2-amino-3-[2-(phosphonomethyl)-3-quinolinyl]propanoic acid IUPAC Name: 2-amino-3-[2-(phosphonomethyl)quinolin-3-yl]propanoic acid Traditional Name: 2-amino-3-[2-(phosphonomethyl)-3-quinolyl]propionic acid Formula: C13H15N2O5P MolecularWeight: 310.242361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)CP(=O)(O)O)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)CP(=O)(O)O)CC(C(=O)O)N

InChI

InChI=1S/C13H15N2O5P/c14-10(13(16)17)6-9-5-8-3-1-2-4-11(8)15-12(9)7-21(18,19)20/h1-5,10H,6-7,14H2,(H,16,17)(H2,18,19,20)