5-nitro-2-(2,4,6-trimethylphenyl)isoindole-1,3-dione

Systemtic Name: 5-nitro-2-(2,4,6-trimethylphenyl)isoindole-1,3-dione Openeye Name: 5-nitro-2-(2,4,6-trimethylphenyl)isoindoline-1,3-dione CAS Name: 5-nitro-2-(2,4,6-trimethylphenyl)isoindole-1,3-dione IUPAC Name: 5-nitro-2-(2,4,6-trimethylphenyl)isoindole-1,3-dione Traditional Name: 2-mesityl-5-nitro-isoindoline-1,3-quinone Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O4/c1-9-6-10(2)15(11(3)7-9)18-16(20)13-5-4-12(19(22)23)8-14(13)17(18)21/h4-8H,1-3H3