methyl 3-(3,5-dimethoxyphenyl)-6-methoxy-2-(4-nitrophenyl)-1-benzofuran-4-carboxylate

Systemtic Name: methyl 3-(3,5-dimethoxyphenyl)-6-methoxy-2-(4-nitrophenyl)-1-benzofuran-4-carboxylate Openeye Name: methyl 3-(3,5-dimethoxyphenyl)-6-methoxy-2-(4-nitrophenyl)benzofuran-4-carboxylate CAS Name: 3-(3,5-dimethoxyphenyl)-6-methoxy-2-(4-nitrophenyl)-4-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 3-(3,5-dimethoxyphenyl)-6-methoxy-2-(4-nitrophenyl)-1-benzofuran-4-carboxylate Traditional Name: 3-(3,5-dimethoxyphenyl)-6-methoxy-2-(4-nitrophenyl)benzofuran-4-carboxylic acid methyl ester Formula: C25H21NO8 MolecularWeight: 463.43614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=C(OC3=C2C(=CC(=C3)OC)C(=O)OC)C4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=C(OC3=C2C(=CC(=C3)OC)C(=O)OC)C4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H21NO8/c1-30-17-9-15(10-18(11-17)31-2)22-23-20(25(27)33-4)12-19(32-3)13-21(23)34-24(22)14-5-7-16(8-6-14)26(28)29/h5-13H,1-4H3