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

Systemtic Name: 2-(2-methoxy-5-methyl-phenyl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(2-methoxy-5-methyl-phenyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(2-methoxy-5-methylphenyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(2-methoxy-5-methylphenyl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(2-methoxy-5-methyl-phenyl)-5-nitro-isoindoline-1,3-quinone Formula: C16H12N2O5 MolecularWeight: 312.27688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O5/c1-9-3-6-14(23-2)13(7-9)17-15(19)11-5-4-10(18(21)22)8-12(11)16(17)20/h3-8H,1-2H3