3-[(3-propan-2-ylphenyl)amino]propanoic acid

Systemtic Name: 3-[(3-propan-2-ylphenyl)amino]propanoic acid Openeye Name: 3-(3-isopropylanilino)propanoic acid CAS Name: 3-(3-propan-2-ylanilino)propanoic acid IUPAC Name: 3-(3-propan-2-ylanilino)propanoic acid Traditional Name: 3-(3-isopropylanilino)propionic acid Formula: C12H17NO2 MolecularWeight: 207.26888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-9(2)10-4-3-5-11(8-10)13-7-6-12(14)15/h3-5,8-9,13H,6-7H2,1-2H3,(H,14,15)