[3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: [3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: [3-(1-naphthyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-(4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)butanoic 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] 4-(4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)butyric acid [4-keto-3-(1-naphthyl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C32H24ClF3O5 MolecularWeight: 580.97817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C32H24ClF3O5/c1-18-15-22(16-19(2)29(18)33)39-14-6-11-27(37)40-21-12-13-25-26(17-21)41-31(32(34,35)36)28(30(25)38)24-10-5-8-20-7-3-4-9-23(20)24/h3-5,7-10,12-13,15-17H,6,11,14H2,1-2H3