(2-methoxy-5-nitro-phenyl)methyl 2-(2,5-dimethylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 2-(2,5-dimethylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 2-(2,5-dimethylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2,5-dimethylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2,5-dimethylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid (2-methoxy-5-nitro-benzyl) ester Formula: C25H20N2O7 MolecularWeight: 460.4355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=C(C=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H20N2O7/c1-14-4-5-15(2)21(10-14)26-23(28)19-8-6-16(12-20(19)24(26)29)25(30)34-13-17-11-18(27(31)32)7-9-22(17)33-3/h4-12H,13H2,1-3H3