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

Systemtic Name: [3-naphthalen-2-yloxy-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-bromanylbenzoate Openeye Name: [3-(2-naphthyloxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [3-(2-naphthalenyloxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-naphthalen-2-yloxy-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-keto-3-(2-naphthoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H14BrF3O5 MolecularWeight: 555.29627

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC3=C(OC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC(=CC=C5)Br)C(F)(F)F

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC3=C(OC4=C(C3=O)C=CC(=C4)OC(=O)C5=CC(=CC=C5)Br)C(F)(F)F

InChI

InChI=1S/C27H14BrF3O5/c28-18-7-3-6-17(12-18)26(33)35-20-10-11-21-22(14-20)36-25(27(29,30)31)24(23(21)32)34-19-9-8-15-4-1-2-5-16(15)13-19/h1-14H