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

Systemtic Name: 4-methyl-2-(2-methyl-4-nitro-phenyl)isoindole-1,3-dione Openeye Name: 4-methyl-2-(2-methyl-4-nitro-phenyl)isoindoline-1,3-dione CAS Name: 4-methyl-2-(2-methyl-4-nitrophenyl)isoindole-1,3-dione IUPAC Name: 4-methyl-2-(2-methyl-4-nitrophenyl)isoindole-1,3-dione Traditional Name: 4-methyl-2-(2-methyl-4-nitro-phenyl)isoindoline-1,3-quinone Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=O)N(C2=O)C3=C(C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC2=C1C(=O)N(C2=O)C3=C(C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H12N2O4/c1-9-4-3-5-12-14(9)16(20)17(15(12)19)13-7-6-11(18(21)22)8-10(13)2/h3-8H,1-2H3