2-[(6-nitrobenzimidazol-1-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(6-nitrobenzimidazol-1-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(6-nitrobenzimidazol-1-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(6-nitro-1-benzimidazolyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(6-nitrobenzimidazol-1-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(6-nitrobenzimidazol-1-yl)methyl]isoindoline-1,3-quinone Formula: C16H10N4O4 MolecularWeight: 322.275

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CN3C=NC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CN3C=NC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O4/c21-15-11-3-1-2-4-12(11)16(22)19(15)9-18-8-17-13-6-5-10(20(23)24)7-14(13)18/h1-8H,9H2