2-[(2-cyano-5-propoxy-phenyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[(2-cyano-5-propoxy-phenyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(2-cyano-5-propoxy-anilino)-2-oxo-acetic acid CAS Name: 2-(2-cyano-5-propoxyanilino)-2-oxoacetic acid IUPAC Name: 2-(2-cyano-5-propoxyanilino)-2-oxoacetic acid Traditional Name: 2-(2-cyano-5-propoxy-anilino)-2-keto-acetic acid Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C#N)NC(=O)C(=O)O

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C#N)NC(=O)C(=O)O

InChI

InChI=1S/C12H12N2O4/c1-2-5-18-9-4-3-8(7-13)10(6-9)14-11(15)12(16)17/h3-4,6H,2,5H2,1H3,(H,14,15)(H,16,17)