[4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxy-phenyl] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxy-phenyl] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [4-[2-(2,4-dinitrophenyl)vinyl]-2-methoxy-phenyl] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxyphenyl] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [4-[2-(2,4-dinitrophenyl)vinyl]-2-methoxy-phenyl] ester Formula: C25H16N2O9 MolecularWeight: 488.40254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

COC1=C(C=CC(=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C25H16N2O9/c1-34-23-12-15(6-8-16-9-10-18(26(30)31)14-20(16)27(32)33)7-11-22(23)36-25(29)19-13-17-4-2-3-5-21(17)35-24(19)28/h2-14H,1H3