2-(4-chloranyl-2-methyl-phenyl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(4-chloranyl-2-methyl-phenyl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(4-chloro-2-methyl-phenyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(4-chloro-2-methylphenyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(4-chloro-2-methylphenyl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(4-chloro-2-methyl-phenyl)-5-nitro-isoindoline-1,3-quinone Formula: C15H9ClN2O4 MolecularWeight: 316.69596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClN2O4/c1-8-6-9(16)2-5-13(8)17-14(19)11-4-3-10(18(21)22)7-12(11)15(17)20/h2-7H,1H3