5-[(3-ethylphenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-ethylphenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3-ethylanilino)-5-oxo-pentanoic acid CAS Name: 5-(3-ethylanilino)-5-oxopentanoic acid IUPAC Name: 5-(3-ethylanilino)-5-oxopentanoic acid Traditional Name: 5-(3-ethylanilino)-5-keto-valeric acid Formula: C13H17NO3 MolecularWeight: 235.27898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CCCC(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CCCC(=O)O

InChI

InChI=1S/C13H17NO3/c1-2-10-5-3-6-11(9-10)14-12(15)7-4-8-13(16)17/h3,5-6,9H,2,4,7-8H2,1H3,(H,14,15)(H,16,17)