4-(3-methoxyphenyl)-4-oxidanylidene-2-(propanoylamino)butanoic acid

Systemtic Name: 4-(3-methoxyphenyl)-4-oxidanylidene-2-(propanoylamino)butanoic acid Openeye Name: 4-(3-methoxyphenyl)-4-oxo-2-(propanoylamino)butanoic acid CAS Name: 4-(3-methoxyphenyl)-4-oxo-2-(1-oxopropylamino)butanoic acid IUPAC Name: 4-(3-methoxyphenyl)-4-oxo-2-(propanoylamino)butanoic acid Traditional Name: 4-keto-4-(3-methoxyphenyl)-2-propionamido-butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC(=O)C1=CC(=CC=C1)OC)C(=O)O

Isomeric SMILES

CCC(=O)NC(CC(=O)C1=CC(=CC=C1)OC)C(=O)O

InChI

InChI=1S/C14H17NO5/c1-3-13(17)15-11(14(18)19)8-12(16)9-5-4-6-10(7-9)20-2/h4-7,11H,3,8H2,1-2H3,(H,15,17)(H,18,19)