[3-(4-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-chloranyl-5-nitro-benzoate

Systemtic Name: [3-(4-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-chloranyl-5-nitro-benzoate Openeye Name: [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [4-keto-3-(4-methoxyphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H13ClF3NO8 MolecularWeight: 535.81013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)C(F)(F)F

InChI

InChI=1S/C24H13ClF3NO8/c1-34-13-3-5-14(6-4-13)35-21-20(30)16-8-7-15(11-19(16)37-22(21)24(26,27)28)36-23(31)17-10-12(29(32)33)2-9-18(17)25/h2-11H,1H3