2-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(4-methyl-3-nitrophenyl)-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-methyl-3-nitrophenyl)-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(4-methyl-3-nitro-phenyl)ethyl]isoindoline-1,3-quinone Formula: C17H12N2O5 MolecularWeight: 324.28758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O5/c1-10-6-7-11(8-14(10)19(23)24)15(20)9-18-16(21)12-4-2-3-5-13(12)17(18)22/h2-8H,9H2,1H3