ethyl 4-chloranyl-5-cyano-2-oxidanyl-3-phenyl-benzoate

Systemtic Name: ethyl 4-chloranyl-5-cyano-2-oxidanyl-3-phenyl-benzoate Openeye Name: ethyl 4-chloro-5-cyano-2-hydroxy-3-phenyl-benzoate CAS Name: 4-chloro-5-cyano-2-hydroxy-3-phenylbenzoic acid ethyl ester IUPAC Name: ethyl 4-chloro-5-cyano-2-hydroxy-3-phenylbenzoate Traditional Name: 4-chloro-5-cyano-2-hydroxy-3-phenyl-benzoic acid ethyl ester Formula: C16H12ClNO3 MolecularWeight: 301.72438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C(=C1)C#N)Cl)C2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C(=C1)C#N)Cl)C2=CC=CC=C2)O

InChI

InChI=1S/C16H12ClNO3/c1-2-21-16(20)12-8-11(9-18)14(17)13(15(12)19)10-6-4-3-5-7-10/h3-8,19H,2H2,1H3