2-[4-(2-acetamidopropanoylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-acetamidopropanoylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(2-acetamidopropanoylamino)phenyl]acetic acid CAS Name: 2-[4-[(2-acetamido-1-oxopropyl)amino]phenyl]acetic acid IUPAC Name: 2-[4-(2-acetamidopropanoylamino)phenyl]acetic acid Traditional Name: 2-[4-(2-acetamidopropanoylamino)phenyl]acetic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)CC(=O)O)NC(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)CC(=O)O)NC(=O)C

InChI

InChI=1S/C13H16N2O4/c1-8(14-9(2)16)13(19)15-11-5-3-10(4-6-11)7-12(17)18/h3-6,8H,7H2,1-2H3,(H,14,16)(H,15,19)(H,17,18)