[3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] 3,4-bis(chloranyl)benzoate

Systemtic Name: [3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] 3,4-bis(chloranyl)benzoate Openeye Name: [3-(4-chlorophenyl)-6-hexyl-4-oxo-chromen-7-yl] 3,4-dichlorobenzoate CAS Name: 3,4-dichlorobenzoic acid [3-(4-chlorophenyl)-6-hexyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl] 3,4-dichlorobenzoate Traditional Name: 3,4-dichlorobenzoic acid [3-(4-chlorophenyl)-6-hexyl-4-keto-chromen-7-yl] ester Formula: C28H23Cl3O4 MolecularWeight: 529.83882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C28H23Cl3O4/c1-2-3-4-5-6-18-13-21-26(34-16-22(27(21)32)17-7-10-20(29)11-8-17)15-25(18)35-28(33)19-9-12-23(30)24(31)14-19/h7-16H,2-6H2,1H3