[6,6-bis(fluoranyl)-5-(trifluoromethyl)hex-5-enyl] 4-butoxybenzoate

Systemtic Name: [6,6-bis(fluoranyl)-5-(trifluoromethyl)hex-5-enyl] 4-butoxybenzoate Openeye Name: [6,6-difluoro-5-(trifluoromethyl)hex-5-enyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [6,6-difluoro-5-(trifluoromethyl)hex-5-enyl] ester IUPAC Name: [6,6-difluoro-5-(trifluoromethyl)hex-5-enyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [6,6-difluoro-5-(trifluoromethyl)hex-5-enyl] ester Formula: C18H21F5O3 MolecularWeight: 380.349556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCCCCC(=C(F)F)C(F)(F)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCCCCC(=C(F)F)C(F)(F)F

InChI

InChI=1S/C18H21F5O3/c1-2-3-11-25-14-9-7-13(8-10-14)17(24)26-12-5-4-6-15(16(19)20)18(21,22)23/h7-10H,2-6,11-12H2,1H3