2-[4-(2,5-dimethylpyrrol-1-yl)-1,2,5-oxadiazol-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[4-(2,5-dimethylpyrrol-1-yl)-1,2,5-oxadiazol-3-yl]isoindole-1,3-dione Openeye Name: 2-[4-(2,5-dimethylpyrrol-1-yl)-1,2,5-oxadiazol-3-yl]isoindoline-1,3-dione CAS Name: 2-[4-(2,5-dimethyl-1-pyrrolyl)-1,2,5-oxadiazol-3-yl]isoindole-1,3-dione IUPAC Name: 2-[4-(2,5-dimethylpyrrol-1-yl)-1,2,5-oxadiazol-3-yl]isoindole-1,3-dione Traditional Name: 2-[4-(2,5-dimethylpyrrol-1-yl)furazan-3-yl]isoindoline-1,3-quinone Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NON=C2N3C(=O)C4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=CC=C(N1C2=NON=C2N3C(=O)C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C16H12N4O3/c1-9-7-8-10(2)19(9)13-14(18-23-17-13)20-15(21)11-5-3-4-6-12(11)16(20)22/h3-8H,1-2H3