2-(4-iodanyl-2-methyl-phenyl)-5-(4-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-(4-iodanyl-2-methyl-phenyl)-5-(4-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-(4-iodo-2-methyl-phenyl)-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(4-iodo-2-methylphenyl)-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(4-iodo-2-methylphenyl)-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(4-iodo-2-methyl-phenyl)-5-(4-nitrophenoxy)isoindoline-1,3-quinone Formula: C21H13IN2O5 MolecularWeight: 500.24279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)I)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13IN2O5/c1-12-10-13(22)2-9-19(12)23-20(25)17-8-7-16(11-18(17)21(23)26)29-15-5-3-14(4-6-15)24(27)28/h2-11H,1H3