2-[(4-butylphenyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[(4-butylphenyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(4-butylanilino)-2-oxo-acetic acid CAS Name: 2-(4-butylanilino)-2-oxoacetic acid IUPAC Name: 2-(4-butylanilino)-2-oxoacetic acid Traditional Name: 2-(4-butylanilino)-2-keto-acetic acid Formula: C12H15NO3 MolecularWeight: 221.2524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(=O)O

InChI

InChI=1S/C12H15NO3/c1-2-3-4-9-5-7-10(8-6-9)13-11(14)12(15)16/h5-8H,2-4H2,1H3,(H,13,14)(H,15,16)