[2-[2,4-bis(bromanyl)phenyl]-3-oxidanylidene-cyclohexen-1-yl] hexanoate

Systemtic Name: [2-[2,4-bis(bromanyl)phenyl]-3-oxidanylidene-cyclohexen-1-yl] hexanoate Openeye Name: [2-(2,4-dibromophenyl)-3-oxo-cyclohexen-1-yl] hexanoate CAS Name: hexanoic acid [2-(2,4-dibromophenyl)-3-oxo-1-cyclohexenyl] ester IUPAC Name: [2-(2,4-dibromophenyl)-3-oxocyclohexen-1-yl] hexanoate Traditional Name: hexanoic acid [2-(2,4-dibromophenyl)-3-keto-cyclohexen-1-yl] ester Formula: C18H20Br2O3 MolecularWeight: 444.1576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(C(=O)CCC1)C2=C(C=C(C=C2)Br)Br

Isomeric SMILES

CCCCCC(=O)OC1=C(C(=O)CCC1)C2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C18H20Br2O3/c1-2-3-4-8-17(22)23-16-7-5-6-15(21)18(16)13-10-9-12(19)11-14(13)20/h9-11H,2-8H2,1H3