methyl (2E,4Z)-4-butyl-5-[4-(trifluoromethyl)phenyl]nona-2,4-dienoate

Systemtic Name: methyl (2E,4Z)-4-butyl-5-[4-(trifluoromethyl)phenyl]nona-2,4-dienoate Openeye Name: methyl (2E,4Z)-4-butyl-5-[4-(trifluoromethyl)phenyl]nona-2,4-dienoate CAS Name: (2E,4Z)-4-butyl-5-[4-(trifluoromethyl)phenyl]nona-2,4-dienoic acid methyl ester IUPAC Name: methyl (2E,4Z)-4-butyl-5-[4-(trifluoromethyl)phenyl]nona-2,4-dienoate Traditional Name: (2E,4Z)-4-butyl-5-[4-(trifluoromethyl)phenyl]nona-2,4-dienoic acid methyl ester Formula: C21H27F3O2 MolecularWeight: 368.43309

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(CCCC)C1=CC=C(C=C1)C(F)(F)F)C=CC(=O)OC

Isomeric SMILES

CCCC/C(=C(\CCCC)/C1=CC=C(C=C1)C(F)(F)F)/C=C/C(=O)OC

InChI

InChI=1S/C21H27F3O2/c1-4-6-8-16(12-15-20(25)26-3)19(9-7-5-2)17-10-13-18(14-11-17)21(22,23)24/h10-15H,4-9H2,1-3H3/b15-12+,19-16-