2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 2-azanylpentanedioic acid

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 2-azanylpentanedioic acid Openeye Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 2-aminopentanedioic acid CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 2-aminopentanedioic acid IUPAC Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 2-aminopentanedioic acid Traditional Name: 2-aminoglutaric acid; 2-amino-3-(4-hydroxyphenyl)propionic acid Formula: C14H20N2O7 MolecularWeight: 328.3178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO3.C5H9NO4/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;6-3(5(9)10)1-2-4(7)8/h1-4,8,11H,5,10H2,(H,12,13);3H,1-2,6H2,(H,7,8)(H,9,10)