[4-oxidanylidene-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 4-tert-butylbenzoate

Systemtic Name: [4-oxidanylidene-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 4-tert-butylbenzoate Openeye Name: [4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [4-oxo-3-phenyl-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [4-keto-3-phenyl-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H21F3O4 MolecularWeight: 466.44845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C27H21F3O4/c1-26(2,3)18-11-9-17(10-12-18)25(32)33-19-13-14-20-21(15-19)34-24(27(28,29)30)22(23(20)31)16-7-5-4-6-8-16/h4-15H,1-3H3