[4-[(E)-2-cyano-2-pyridin-2-yl-ethenyl]phenyl] 3,5-bis(chloranyl)benzoate

Systemtic Name: [4-[(E)-2-cyano-2-pyridin-2-yl-ethenyl]phenyl] 3,5-bis(chloranyl)benzoate Openeye Name: [4-[(E)-2-cyano-2-(2-pyridyl)vinyl]phenyl] 3,5-dichlorobenzoate CAS Name: 3,5-dichlorobenzoic acid [4-[(E)-2-cyano-2-(2-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-cyano-2-pyridin-2-ylethenyl]phenyl] 3,5-dichlorobenzoate Traditional Name: 3,5-dichlorobenzoic acid [4-[(E)-2-cyano-2-(2-pyridyl)vinyl]phenyl] ester Formula: C21H12Cl2N2O2 MolecularWeight: 395.23818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=CC2=CC=C(C=C2)OC(=O)C3=CC(=CC(=C3)Cl)Cl)C#N

Isomeric SMILES

C1=CC=NC(=C1)/C(=C\C2=CC=C(C=C2)OC(=O)C3=CC(=CC(=C3)Cl)Cl)/C#N

InChI

InChI=1S/C21H12Cl2N2O2/c22-17-10-15(11-18(23)12-17)21(26)27-19-6-4-14(5-7-19)9-16(13-24)20-3-1-2-8-25-20/h1-12H/b16-9-