4-oxidanylidene-4-[[2-(prop-2-enylcarbamoyl)phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2-(prop-2-enylcarbamoyl)phenyl]amino]butanoic acid Openeye Name: 4-[2-(allylcarbamoyl)anilino]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[2-[oxo-(prop-2-enylamino)methyl]anilino]butanoic acid IUPAC Name: 4-oxo-4-[2-(prop-2-enylcarbamoyl)anilino]butanoic acid Traditional Name: 4-[2-(allylcarbamoyl)anilino]-4-keto-butyric acid Formula: C14H16N2O4 MolecularWeight: 276.28784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC=CC=C1NC(=O)CCC(=O)O

Isomeric SMILES

C=CCNC(=O)C1=CC=CC=C1NC(=O)CCC(=O)O

InChI

InChI=1S/C14H16N2O4/c1-2-9-15-14(20)10-5-3-4-6-11(10)16-12(17)7-8-13(18)19/h2-6H,1,7-9H2,(H,15,20)(H,16,17)(H,18,19)