2-[(3-methylphenyl)carbonyl-propan-2-yl-amino]butanoic acid

Systemtic Name: 2-[(3-methylphenyl)carbonyl-propan-2-yl-amino]butanoic acid Openeye Name: 2-[isopropyl-(3-methylbenzoyl)amino]butanoic acid CAS Name: 2-[[(3-methylphenyl)-oxomethyl]-propan-2-ylamino]butanoic acid IUPAC Name: 2-[(3-methylbenzoyl)-propan-2-ylamino]butanoic acid Traditional Name: 2-[isopropyl(m-toluoyl)amino]butyric acid Formula: C15H21NO3 MolecularWeight: 263.33214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N(C(C)C)C(=O)C1=CC(=CC=C1)C

Isomeric SMILES

CCC(C(=O)O)N(C(C)C)C(=O)C1=CC(=CC=C1)C

InChI

InChI=1S/C15H21NO3/c1-5-13(15(18)19)16(10(2)3)14(17)12-8-6-7-11(4)9-12/h6-10,13H,5H2,1-4H3,(H,18,19)