ethyl 4-(4-bromophenyl)-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-oxidanylidene-6-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-oxo-6-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: 4-(4-bromophenyl)-2-oxo-6-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate Traditional Name: 4-(4-bromophenyl)-2-keto-6-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C21H19BrO3 MolecularWeight: 399.27776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrO3/c1-2-25-21(24)20-18(15-6-4-3-5-7-15)12-16(13-19(20)23)14-8-10-17(22)11-9-14/h3-11,13,18,20H,2,12H2,1H3