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

Systemtic Name: [3-(4-methoxycarbonylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Openeye Name: [3-(4-methoxycarbonylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-(4-methoxycarbonylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-methoxycarbonylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-(4-carbomethoxyphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H14F3NO9 MolecularWeight: 529.37517

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C25H14F3NO9/c1-35-23(31)13-5-7-16(8-6-13)36-21-20(30)18-10-9-17(12-19(18)38-22(21)25(26,27)28)37-24(32)14-3-2-4-15(11-14)29(33)34/h2-12H,1H3