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

Systemtic Name: 2-[(5-chloranyl-2-cyano-phenyl)-propyl-amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(5-chloro-2-cyano-N-propyl-anilino)-2-oxo-acetic acid CAS Name: 2-(5-chloro-2-cyano-N-propylanilino)-2-oxoacetic acid IUPAC Name: 2-(5-chloro-2-cyano-N-propylanilino)-2-oxoacetic acid Traditional Name: 2-(5-chloro-2-cyano-N-propyl-anilino)-2-keto-acetic acid Formula: C12H11ClN2O3 MolecularWeight: 266.68034

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=CC(=C1)Cl)C#N)C(=O)C(=O)O

Isomeric SMILES

CCCN(C1=C(C=CC(=C1)Cl)C#N)C(=O)C(=O)O

InChI

InChI=1S/C12H11ClN2O3/c1-2-5-15(11(16)12(17)18)10-6-9(13)4-3-8(10)7-14/h3-4,6H,2,5H2,1H3,(H,17,18)