4-pentan-3-yl-3-[2,2,2-tris(fluoranyl)ethoxy]-3,4-dihydroisochromen-1-one

Systemtic Name: 4-pentan-3-yl-3-[2,2,2-tris(fluoranyl)ethoxy]-3,4-dihydroisochromen-1-one Openeye Name: 4-(1-ethylpropyl)-3-(2,2,2-trifluoroethoxy)isochroman-1-one CAS Name: 4-pentan-3-yl-3-(2,2,2-trifluoroethoxy)-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 4-pentan-3-yl-3-(2,2,2-trifluoroethoxy)-3,4-dihydroisochromen-1-one Traditional Name: 4-(1-ethylpropyl)-3-(2,2,2-trifluoroethoxy)isochroman-1-one Formula: C16H19F3O3 MolecularWeight: 316.31547

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1C(OC(=O)C2=CC=CC=C12)OCC(F)(F)F

Isomeric SMILES

CCC(CC)C1C(OC(=O)C2=CC=CC=C12)OCC(F)(F)F

InChI

InChI=1S/C16H19F3O3/c1-3-10(4-2)13-11-7-5-6-8-12(11)14(20)22-15(13)21-9-16(17,18)19/h5-8,10,13,15H,3-4,9H2,1-2H3