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octan-2-yl 3-(trifluoromethyl)benzoate

octan-2-yl 3-(trifluoromethyl)benzoate

Systemtic Name:octan-2-yl 3-(trifluoromethyl)benzoate
Openeye Name:1-methylheptyl 3-(trifluoromethyl)benzoate
CAS Name:3-(trifluoromethyl)benzoic acid octan-2-yl ester
IUPAC Name:octan-2-yl 3-(trifluoromethyl)benzoate
Traditional Name:3-(trifluoromethyl)benzoic acid 1-methylheptyl ester
Formula: C16H21F3O2
MolecularWeight: 302.33195
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H21F3O2/c1-3-4-5-6-8-12(2)21-15(20)13-9-7-10-14(11-13)16(17,18)19/h7,9-12H,3-6,8H2,1-2H3


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