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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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