6-[(3-methylphenyl)carbamoylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(3-methylphenyl)carbamoylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(m-tolylcarbamoylamino)-6-oxo-hexanoic acid CAS Name: 6-[[(3-methylanilino)-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 6-[(3-methylphenyl)carbamoylamino]-6-oxohexanoic acid Traditional Name: 6-keto-6-(m-tolylcarbamoylamino)hexanoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC(=O)CCCCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C14H18N2O4/c1-10-5-4-6-11(9-10)15-14(20)16-12(17)7-2-3-8-13(18)19/h4-6,9H,2-3,7-8H2,1H3,(H,18,19)(H2,15,16,17,20)