6-[[2-(methylcarbamoyl)phenyl]amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[[2-(methylcarbamoyl)phenyl]amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[2-(methylcarbamoyl)anilino]-6-oxo-hexanoic acid CAS Name: 6-[2-(methylcarbamoyl)anilino]-6-oxohexanoic acid IUPAC Name: 6-[2-(methylcarbamoyl)anilino]-6-oxohexanoic acid Traditional Name: 6-keto-6-[2-(methylcarbamoyl)anilino]hexanoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1NC(=O)CCCCC(=O)O

Isomeric SMILES

CNC(=O)C1=CC=CC=C1NC(=O)CCCCC(=O)O

InChI

InChI=1S/C14H18N2O4/c1-15-14(20)10-6-2-3-7-11(10)16-12(17)8-4-5-9-13(18)19/h2-3,6-7H,4-5,8-9H2,1H3,(H,15,20)(H,16,17)(H,18,19)