ethyl 4,4,4-tris(fluoranyl)-3-oxidanylidene-2-[[2-(phenylmethyl)-3,4-dihydro-2H-chromen-6-yl]methyl]butanoate

Systemtic Name: ethyl 4,4,4-tris(fluoranyl)-3-oxidanylidene-2-[[2-(phenylmethyl)-3,4-dihydro-2H-chromen-6-yl]methyl]butanoate Openeye Name: ethyl 2-[(2-benzylchroman-6-yl)methyl]-4,4,4-trifluoro-3-oxo-butanoate CAS Name: 4,4,4-trifluoro-3-oxo-2-[[2-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]methyl]butanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzyl-3,4-dihydro-2H-chromen-6-yl)methyl]-4,4,4-trifluoro-3-oxobutanoate Traditional Name: 2-[(2-benzylchroman-6-yl)methyl]-4,4,4-trifluoro-3-keto-butyric acid ethyl ester Formula: C23H23F3O4 MolecularWeight: 420.42153

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1)OC(CC2)CC3=CC=CC=C3)C(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1)OC(CC2)CC3=CC=CC=C3)C(=O)C(F)(F)F

InChI

InChI=1S/C23H23F3O4/c1-2-29-22(28)19(21(27)23(24,25)26)14-16-8-11-20-17(12-16)9-10-18(30-20)13-15-6-4-3-5-7-15/h3-8,11-12,18-19H,2,9-10,13-14H2,1H3