4-chloranyl-3-ethyl-benzoate dicyanate

Systemtic Name: 4-chloranyl-3-ethyl-benzoate dicyanate Openeye Name: 4-chloro-3-ethyl-benzoate dicyanate CAS Name: 4-chloro-3-ethylbenzoate dicyanate IUPAC Name: 4-chloro-3-ethylbenzoate dicyanate Traditional Name: 4-chloro-3-ethyl-benzoate dicyanate Formula: C11H8ClN2O4-3 MolecularWeight: 267.64522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C(=O)[O-])Cl.C(#N)[O-].C(#N)[O-]

Isomeric SMILES

CCC1=C(C=CC(=C1)C(=O)[O-])Cl.C(#N)[O-].C(#N)[O-]

InChI

InChI=1S/C9H9ClO2.2CHNO/c1-2-6-5-7(9(11)12)3-4-8(6)10;2*2-1-3/h3-5H,2H2,1H3,(H,11,12);2*3H/p-3