[(E,11R)-11-oxidanyl-4-oxidanylidene-dodec-2-enoyl] 2,4,6-tris(chloranyl)benzoate

Systemtic Name: [(E,11R)-11-oxidanyl-4-oxidanylidene-dodec-2-enoyl] 2,4,6-tris(chloranyl)benzoate Openeye Name: [(E,11R)-11-hydroxy-4-oxo-dodec-2-enoyl] 2,4,6-trichlorobenzoate CAS Name: 2,4,6-trichlorobenzoic acid [(E,11R)-11-hydroxy-1,4-dioxododec-2-enyl] ester IUPAC Name: [(E,11R)-11-hydroxy-4-oxododec-2-enoyl] 2,4,6-trichlorobenzoate Traditional Name: 2,4,6-trichlorobenzoic acid [(E,11R)-11-hydroxy-4-keto-dodec-2-enoyl] ester Formula: C19H21Cl3O5 MolecularWeight: 435.72604

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCC(=O)C=CC(=O)OC(=O)C1=C(C=C(C=C1Cl)Cl)Cl)O

Isomeric SMILES

C[C@H](CCCCCCC(=O)/C=C/C(=O)OC(=O)C1=C(C=C(C=C1Cl)Cl)Cl)O

InChI

InChI=1S/C19H21Cl3O5/c1-12(23)6-4-2-3-5-7-14(24)8-9-17(25)27-19(26)18-15(21)10-13(20)11-16(18)22/h8-12,23H,2-7H2,1H3/b9-8+/t12-/m1/s1