[4-[1,3-bis(oxidanylidene)isoindol-2-yl]cyclohexyl] 4-nitrobenzoate

Systemtic Name: [4-[1,3-bis(oxidanylidene)isoindol-2-yl]cyclohexyl] 4-nitrobenzoate Openeye Name: [4-(1,3-dioxoisoindolin-2-yl)cyclohexyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-(1,3-dioxo-2-isoindolyl)cyclohexyl] ester IUPAC Name: [4-(1,3-dioxoisoindol-2-yl)cyclohexyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4-phthalimidocyclohexyl) ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2C(=O)C3=CC=CC=C3C2=O)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1N2C(=O)C3=CC=CC=C3C2=O)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6/c24-19-17-3-1-2-4-18(17)20(25)22(19)14-9-11-16(12-10-14)29-21(26)13-5-7-15(8-6-13)23(27)28/h1-8,14,16H,9-12H2