[3-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] 2-iodanylbenzoate

Systemtic Name: [3-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] 2-iodanylbenzoate Openeye Name: [3-(1,3-dioxoisoindolin-2-yl)phenyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [3-(1,3-dioxo-2-isoindolyl)phenyl] ester IUPAC Name: [3-(1,3-dioxoisoindol-2-yl)phenyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid (3-phthalimidophenyl) ester Formula: C21H12INO4 MolecularWeight: 469.22875

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC(=CC=C3)OC(=O)C4=CC=CC=C4I

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC(=CC=C3)OC(=O)C4=CC=CC=C4I

InChI

InChI=1S/C21H12INO4/c22-18-11-4-3-10-17(18)21(26)27-14-7-5-6-13(12-14)23-19(24)15-8-1-2-9-16(15)20(23)25/h1-12H