[3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-bromanylbenzoate

Systemtic Name: [3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-bromanylbenzoate Openeye Name: [3-(1-naphthyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [3-(1-naphthalenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-naphthalen-1-yl-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-keto-3-(1-naphthyl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H14BrF3O4 MolecularWeight: 539.29687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=C(OC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC(=CC=C5)Br)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=C(OC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC(=CC=C5)Br)C(F)(F)F

InChI

InChI=1S/C27H14BrF3O4/c28-17-8-3-7-16(13-17)26(33)34-18-11-12-21-22(14-18)35-25(27(29,30)31)23(24(21)32)20-10-4-6-15-5-1-2-9-19(15)20/h1-14H