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

Systemtic Name: ethyl 4-[3,5-bis(bromanyl)-4-methoxy-phenyl]-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 4-(3,5-dibromo-4-methoxy-phenyl)-2-oxo-6-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: 4-(3,5-dibromo-4-methoxyphenyl)-2-oxo-6-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,5-dibromo-4-methoxyphenyl)-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate Traditional Name: 4-(3,5-dibromo-4-methoxy-phenyl)-2-keto-6-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C22H20Br2O4 MolecularWeight: 508.1998

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H20Br2O4/c1-3-28-22(26)20-16(13-7-5-4-6-8-13)9-14(12-19(20)25)15-10-17(23)21(27-2)18(24)11-15/h4-8,10-12,16,20H,3,9H2,1-2H3