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

Systemtic Name: ethyl 4-[[2-(4-ethoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[2-(4-ethoxycarbonylphenyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-ethoxycarbonylphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-ethoxycarbonylphenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 4-[[2-(4-carbethoxyphenyl)-1,3-diketo-isoindoline-5-carbonyl]amino]benzoic acid ethyl ester Formula: C27H22N2O7 MolecularWeight: 486.47278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C27H22N2O7/c1-3-35-26(33)16-5-10-19(11-6-16)28-23(30)18-9-14-21-22(15-18)25(32)29(24(21)31)20-12-7-17(8-13-20)27(34)36-4-2/h5-15H,3-4H2,1-2H3,(H,28,30)