2-azanyl-3-[3,4-bis(carboxymethyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3,4-bis(carboxymethyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[3,4-bis(carboxymethyl)phenyl]propanoic acid CAS Name: 2-amino-3-[3,4-bis(carboxymethyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[3,4-bis(carboxymethyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[3,4-bis(carboxymethyl)phenyl]propionic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)N)CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1CC(C(=O)O)N)CC(=O)O)CC(=O)O

InChI

InChI=1S/C13H15NO6/c14-10(13(19)20)4-7-1-2-8(5-11(15)16)9(3-7)6-12(17)18/h1-3,10H,4-6,14H2,(H,15,16)(H,17,18)(H,19,20)