3-[(4-propan-2-ylphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-[(4-propan-2-ylphenyl)carbonylamino]propanoic acid Openeye Name: 3-[(4-isopropylbenzoyl)amino]propanoic acid CAS Name: 3-[[oxo-(4-propan-2-ylphenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(4-propan-2-ylbenzoyl)amino]propanoic acid Traditional Name: 3-(cumoylamino)propionic acid Formula: C13H17NO3 MolecularWeight: 235.27898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NCCC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NCCC(=O)O

InChI

InChI=1S/C13H17NO3/c1-9(2)10-3-5-11(6-4-10)13(17)14-8-7-12(15)16/h3-6,9H,7-8H2,1-2H3,(H,14,17)(H,15,16)