3-chloranyl-4-(cyanomethoxy)-5-ethoxy-benzoate

Systemtic Name: 3-chloranyl-4-(cyanomethoxy)-5-ethoxy-benzoate Openeye Name: 3-chloro-4-(cyanomethoxy)-5-ethoxy-benzoate CAS Name: 3-chloro-4-(cyanomethoxy)-5-ethoxybenzoate IUPAC Name: 3-chloro-4-(cyanomethoxy)-5-ethoxybenzoate Traditional Name: 3-chloro-4-(cyanomethoxy)-5-ethoxy-benzoate Formula: C11H9ClNO4- MolecularWeight: 254.64646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OCC#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OCC#N

InChI

InChI=1S/C11H10ClNO4/c1-2-16-9-6-7(11(14)15)5-8(12)10(9)17-4-3-13/h5-6H,2,4H2,1H3,(H,14,15)/p-1