[4-methyl-3-[2,2,2-tris(chloranyl)ethyl]phenyl] benzoate

Systemtic Name: [4-methyl-3-[2,2,2-tris(chloranyl)ethyl]phenyl] benzoate Openeye Name: [4-methyl-3-(2,2,2-trichloroethyl)phenyl] benzoate CAS Name: benzoic acid [4-methyl-3-(2,2,2-trichloroethyl)phenyl] ester IUPAC Name: [4-methyl-3-(2,2,2-trichloroethyl)phenyl] benzoate Traditional Name: benzoic acid [4-methyl-3-(2,2,2-trichloroethyl)phenyl] ester Formula: C16H13Cl3O2 MolecularWeight: 343.63222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC=CC=C2)CC(Cl)(Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC=CC=C2)CC(Cl)(Cl)Cl

InChI

InChI=1S/C16H13Cl3O2/c1-11-7-8-14(9-13(11)10-16(17,18)19)21-15(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3