[3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-methyl-4-nitro-benzoate

Systemtic Name: [3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-methyl-4-nitro-benzoate Openeye Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-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-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [3-(2-ethoxyphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C26H18F3NO8 MolecularWeight: 529.41823

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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(=C(C=C4)[N+](=O)[O-])C)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C26H18F3NO8/c1-3-35-19-6-4-5-7-20(19)37-23-22(31)17-10-9-16(13-21(17)38-24(23)26(27,28)29)36-25(32)15-8-11-18(30(33)34)14(2)12-15/h4-13H,3H2,1-2H3