[3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate

Systemtic Name: [3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Openeye Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-(2-ethoxyphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H16F3NO8 MolecularWeight: 515.39165

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C25H16F3NO8/c1-2-34-18-8-3-4-9-19(18)36-22-21(30)17-11-10-16(13-20(17)37-23(22)25(26,27)28)35-24(31)14-6-5-7-15(12-14)29(32)33/h3-13H,2H2,1H3