[3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,4-bis(chloranyl)benzoate

Systemtic Name: [3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,4-bis(chloranyl)benzoate Openeye Name: [3-(1-naphthyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,4-dichlorobenzoate CAS Name: 3,4-dichlorobenzoic 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] 3,4-dichlorobenzoate Traditional Name: 3,4-dichlorobenzoic acid [4-keto-3-(1-naphthyl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H13Cl2F3O4 MolecularWeight: 529.29093

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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(=C(C=C5)Cl)Cl)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(=C(C=C5)Cl)Cl)C(F)(F)F

InChI

InChI=1S/C27H13Cl2F3O4/c28-20-11-8-15(12-21(20)29)26(34)35-16-9-10-19-22(13-16)36-25(27(30,31)32)23(24(19)33)18-7-3-5-14-4-1-2-6-17(14)18/h1-13H