[1,1,1-tris(fluoranyl)-3-methyl-but-2-en-2-yl] 4-chloranylbenzoate

Systemtic Name: [1,1,1-tris(fluoranyl)-3-methyl-but-2-en-2-yl] 4-chloranylbenzoate Openeye Name: [2-methyl-1-(trifluoromethyl)prop-1-enyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid (1,1,1-trifluoro-3-methylbut-2-en-2-yl) ester IUPAC Name: (1,1,1-trifluoro-3-methylbut-2-en-2-yl) 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-methyl-1-(trifluoromethyl)prop-1-enyl] ester Formula: C12H10ClF3O2 MolecularWeight: 278.65481

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(F)(F)F)OC(=O)C1=CC=C(C=C1)Cl)C

Isomeric SMILES

CC(=C(C(F)(F)F)OC(=O)C1=CC=C(C=C1)Cl)C

InChI

InChI=1S/C12H10ClF3O2/c1-7(2)10(12(14,15)16)18-11(17)8-3-5-9(13)6-4-8/h3-6H,1-2H3