[6-hexyl-2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl] ethanoate

Systemtic Name: [6-hexyl-2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl] ethanoate Openeye Name: [6-hexyl-2-oxo-4-(trifluoromethyl)chromen-7-yl] acetate CAS Name: acetic acid [6-hexyl-2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [6-hexyl-2-oxo-4-(trifluoromethyl)chromen-7-yl] acetate Traditional Name: acetic acid [6-hexyl-2-keto-4-(trifluoromethyl)chromen-7-yl] ester Formula: C18H19F3O4 MolecularWeight: 356.33627

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C(F)(F)F)OC(=O)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C(F)(F)F)OC(=O)C

InChI

InChI=1S/C18H19F3O4/c1-3-4-5-6-7-12-8-13-14(18(19,20)21)9-17(23)25-16(13)10-15(12)24-11(2)22/h8-10H,3-7H2,1-2H3