6-[(3-methylphenyl)carbonylamino]hexanoate

Systemtic Name: 6-[(3-methylphenyl)carbonylamino]hexanoate Openeye Name: 6-[(3-methylbenzoyl)amino]hexanoate CAS Name: 6-[[(3-methylphenyl)-oxomethyl]amino]hexanoate IUPAC Name: 6-[(3-methylbenzoyl)amino]hexanoate Traditional Name: 6-(m-toluoylamino)hexanoate Formula: C14H18NO3- MolecularWeight: 248.29762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C14H19NO3/c1-11-6-5-7-12(10-11)14(18)15-9-4-2-3-8-13(16)17/h5-7,10H,2-4,8-9H2,1H3,(H,15,18)(H,16,17)/p-1