2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoate

Systemtic Name: 2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoate Openeye Name: 2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoate CAS Name: 2-[[2-ammonio-3-(4-hydroxyphenyl)-1-oxopropyl]amino]propanoate IUPAC Name: 2-[[2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoate Traditional Name: 2-[[2-ammonio-3-(4-hydroxyphenyl)propanoyl]amino]propionate Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)C(CC1=CC=C(C=C1)O)[NH3+]

Isomeric SMILES

CC(C(=O)[O-])NC(=O)C(CC1=CC=C(C=C1)O)[NH3+]

InChI

InChI=1S/C12H16N2O4/c1-7(12(17)18)14-11(16)10(13)6-8-2-4-9(15)5-3-8/h2-5,7,10,15H,6,13H2,1H3,(H,14,16)(H,17,18)