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1-butyl-6-chloranyl-4-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxylate

1-butyl-6-chloranyl-4-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name:1-butyl-6-chloranyl-4-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxylate
Openeye Name:1-butyl-6-chloro-4-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxylate
CAS Name:1-butyl-6-chloro-4-(trifluoromethyl)-1-cyclohexa-2,4-dienecarboxylate
IUPAC Name:1-butyl-6-chloro-4-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxylate
Traditional Name:1-butyl-6-chloro-4-(trifluoromethyl)cyclohexa-2,4-diene-1-carboxylate
Formula: C12H13ClF3O2-
MolecularWeight: 281.67863
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C=CC(=CC1Cl)C(F)(F)F)C(=O)[O-]


Isomeric SMILES

CCCCC1(C=CC(=CC1Cl)C(F)(F)F)C(=O)[O-]


InChI

InChI=1S/C12H14ClF3O2/c1-2-3-5-11(10(17)18)6-4-8(7-9(11)13)12(14,15)16/h4,6-7,9H,2-3,5H2,1H3,(H,17,18)/p-1


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