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

Systemtic Name: [3-(3-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Openeye Name: [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-keto-3-(3-methoxyphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H14F3NO8 MolecularWeight: 501.36507

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=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

COC1=CC=CC(=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/C24H14F3NO8/c1-33-15-6-3-7-16(11-15)34-21-20(29)18-9-8-17(12-19(18)36-22(21)24(25,26)27)35-23(30)13-4-2-5-14(10-13)28(31)32/h2-12H,1H3