ethyl 4-[3,5-bis(bromanyl)-4-methoxy-phenyl]-6-(2-chlorophenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 4-[3,5-bis(bromanyl)-4-methoxy-phenyl]-6-(2-chlorophenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-(2-chlorophenyl)-4-(3,5-dibromo-4-methoxy-phenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 6-(2-chlorophenyl)-4-(3,5-dibromo-4-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-chlorophenyl)-4-(3,5-dibromo-4-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 6-(2-chlorophenyl)-4-(3,5-dibromo-4-methoxy-phenyl)-2-keto-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C22H19Br2ClO4 MolecularWeight: 542.64486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=CC(=C(C(=C2)Br)OC)Br)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1C(CC(=CC1=O)C2=CC(=C(C(=C2)Br)OC)Br)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H19Br2ClO4/c1-3-29-22(27)20-15(14-6-4-5-7-18(14)25)8-12(11-19(20)26)13-9-16(23)21(28-2)17(24)10-13/h4-7,9-11,15,20H,3,8H2,1-2H3