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

Systemtic Name: [3-naphthalen-1-yl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-(2-methylphenoxy)butanoate Openeye Name: [3-(1-naphthyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-(2-methylphenoxy)butanoate CAS Name: 4-(2-methylphenoxy)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-(2-methylphenoxy)butanoate Traditional Name: 4-(2-methylphenoxy)butyric acid [4-keto-3-(1-naphthyl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C31H23F3O5 MolecularWeight: 532.50653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=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=C1OCCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H23F3O5/c1-19-8-2-5-13-25(19)37-17-7-14-27(35)38-21-15-16-24-26(18-21)39-30(31(32,33)34)28(29(24)36)23-12-6-10-20-9-3-4-11-22(20)23/h2-6,8-13,15-16,18H,7,14,17H2,1H3