methyl 4-[[2-(3-acetyloxyphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-(3-acetyloxyphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(3-acetoxyphenyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]benzoate CAS Name: 4-[[[2-(3-acetyloxyphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-acetyloxyphenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 4-[[2-(3-acetoxyphenyl)-1,3-diketo-isoindoline-5-carbonyl]amino]benzoic acid methyl ester Formula: C25H18N2O7 MolecularWeight: 458.41962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H18N2O7/c1-14(28)34-19-5-3-4-18(13-19)27-23(30)20-11-8-16(12-21(20)24(27)31)22(29)26-17-9-6-15(7-10-17)25(32)33-2/h3-13H,1-2H3,(H,26,29)