[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 4-nitrobenzoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 4-nitrobenzoate Openeye Name: [2-(3,4-dimethoxyphenyl)-4-oxo-chromen-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-4-oxochromen-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(3,4-dimethoxyphenyl)-4-keto-chromen-3-yl] ester Formula: C24H17NO8 MolecularWeight: 447.39368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C24H17NO8/c1-30-19-12-9-15(13-20(19)31-2)22-23(21(26)17-5-3-4-6-18(17)32-22)33-24(27)14-7-10-16(11-8-14)25(28)29/h3-13H,1-2H3