5-chloranyl-2-[2-(2-cyanoethylamino)-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 5-chloranyl-2-[2-(2-cyanoethylamino)-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 5-chloro-2-[2-(2-cyanoethylamino)-2-oxo-ethoxy]benzoic acid CAS Name: 5-chloro-2-[2-(2-cyanoethylamino)-2-oxoethoxy]benzoic acid IUPAC Name: 5-chloro-2-[2-(2-cyanoethylamino)-2-oxoethoxy]benzoic acid Traditional Name: 5-chloro-2-[2-(2-cyanoethylamino)-2-keto-ethoxy]benzoic acid Formula: C12H11ClN2O4 MolecularWeight: 282.67974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C(=O)O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)C(=O)O)OCC(=O)NCCC#N

InChI

InChI=1S/C12H11ClN2O4/c13-8-2-3-10(9(6-8)12(17)18)19-7-11(16)15-5-1-4-14/h2-3,6H,1,5,7H2,(H,15,16)(H,17,18)