2-butyl-4-(4-nitroimidazol-1-yl)isoindole-1,3-dione

Systemtic Name: 2-butyl-4-(4-nitroimidazol-1-yl)isoindole-1,3-dione Openeye Name: 2-butyl-4-(4-nitroimidazol-1-yl)isoindoline-1,3-dione CAS Name: 2-butyl-4-(4-nitro-1-imidazolyl)isoindole-1,3-dione IUPAC Name: 2-butyl-4-(4-nitroimidazol-1-yl)isoindole-1,3-dione Traditional Name: 2-butyl-4-(4-nitroimidazol-1-yl)isoindoline-1,3-quinone Formula: C15H14N4O4 MolecularWeight: 314.29606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C(=CC=C2)N3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C(=CC=C2)N3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O4/c1-2-3-7-18-14(20)10-5-4-6-11(13(10)15(18)21)17-8-12(16-9-17)19(22)23/h4-6,8-9H,2-3,7H2,1H3