[4-(2-cyano-2-phenyl-ethenyl)-2-methoxy-phenyl] 2,3,6-tris(chloranyl)benzoate

Systemtic Name: [4-(2-cyano-2-phenyl-ethenyl)-2-methoxy-phenyl] 2,3,6-tris(chloranyl)benzoate Openeye Name: [4-(2-cyano-2-phenyl-vinyl)-2-methoxy-phenyl] 2,3,6-trichlorobenzoate CAS Name: 2,3,6-trichlorobenzoic acid [4-(2-cyano-2-phenylethenyl)-2-methoxyphenyl] ester IUPAC Name: [4-(2-cyano-2-phenylethenyl)-2-methoxyphenyl] 2,3,6-trichlorobenzoate Traditional Name: 2,3,6-trichlorobenzoic acid [4-(2-cyano-2-phenyl-vinyl)-2-methoxy-phenyl] ester Formula: C23H14Cl3NO3 MolecularWeight: 458.72116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=CC=C2)OC(=O)C3=C(C=CC(=C3Cl)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=CC=C2)OC(=O)C3=C(C=CC(=C3Cl)Cl)Cl

InChI

InChI=1S/C23H14Cl3NO3/c1-29-20-12-14(11-16(13-27)15-5-3-2-4-6-15)7-10-19(20)30-23(28)21-17(24)8-9-18(25)22(21)26/h2-12H,1H3