[2,6-bis(chloranyl)-4-phenyl-phenyl] 3-ethyl-2,2-dimethyl-5-oxidanylidene-hexanoate

Systemtic Name: [2,6-bis(chloranyl)-4-phenyl-phenyl] 3-ethyl-2,2-dimethyl-5-oxidanylidene-hexanoate Openeye Name: (2,6-dichloro-4-phenyl-phenyl) 3-ethyl-2,2-dimethyl-5-oxo-hexanoate CAS Name: 3-ethyl-2,2-dimethyl-5-oxohexanoic acid (2,6-dichloro-4-phenylphenyl) ester IUPAC Name: (2,6-dichloro-4-phenylphenyl) 3-ethyl-2,2-dimethyl-5-oxohexanoate Traditional Name: 3-ethyl-5-keto-2,2-dimethyl-hexanoic acid (2,6-dichloro-4-phenyl-phenyl) ester Formula: C22H24Cl2O3 MolecularWeight: 407.33016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)C)C(C)(C)C(=O)OC1=C(C=C(C=C1Cl)C2=CC=CC=C2)Cl

Isomeric SMILES

CCC(CC(=O)C)C(C)(C)C(=O)OC1=C(C=C(C=C1Cl)C2=CC=CC=C2)Cl

InChI

InChI=1S/C22H24Cl2O3/c1-5-17(11-14(2)25)22(3,4)21(26)27-20-18(23)12-16(13-19(20)24)15-9-7-6-8-10-15/h6-10,12-13,17H,5,11H2,1-4H3