3-[2-carboxyethyl-(4-methylphenyl)phosphanyl]propanoic acid

Systemtic Name: 3-[2-carboxyethyl-(4-methylphenyl)phosphanyl]propanoic acid Openeye Name: 3-[2-carboxyethyl(p-tolyl)phosphanyl]propanoic acid CAS Name: 3-[2-carboxyethyl-(4-methylphenyl)phosphino]propanoic acid IUPAC Name: 3-[2-carboxyethyl-(4-methylphenyl)phosphanyl]propanoic acid Traditional Name: 3-[2-carboxyethyl(p-tolyl)phosphino]propionic acid Formula: C13H17O4P MolecularWeight: 268.245441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)P(CCC(=O)O)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)P(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C13H17O4P/c1-10-2-4-11(5-3-10)18(8-6-12(14)15)9-7-13(16)17/h2-5H,6-9H2,1H3,(H,14,15)(H,16,17)