[1-bromanyl-4,4-bis(chloranyl)-2-(3,4-dimethylphenyl)butan-2-yl] methanoate

Systemtic Name: [1-bromanyl-4,4-bis(chloranyl)-2-(3,4-dimethylphenyl)butan-2-yl] methanoate Openeye Name: [1-(bromomethyl)-3,3-dichloro-1-(3,4-dimethylphenyl)propyl] formate CAS Name: formic acid [1-bromo-4,4-dichloro-2-(3,4-dimethylphenyl)butan-2-yl] ester IUPAC Name: [1-bromo-4,4-dichloro-2-(3,4-dimethylphenyl)butan-2-yl] formate Traditional Name: formic acid [1-(bromomethyl)-3,3-dichloro-1-(3,4-dimethylphenyl)propyl] ester Formula: C13H15BrCl2O2 MolecularWeight: 354.067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CC(Cl)Cl)(CBr)OC=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(CC(Cl)Cl)(CBr)OC=O)C

InChI

InChI=1S/C13H15BrCl2O2/c1-9-3-4-11(5-10(9)2)13(7-14,18-8-17)6-12(15)16/h3-5,8,12H,6-7H2,1-2H3