2-[4-[4-(4-nitrophenyl)imidazol-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(4-nitrophenyl)imidazol-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(4-nitrophenyl)imidazol-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(4-nitrophenyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(4-nitrophenyl)imidazol-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(4-nitrophenyl)imidazol-1-yl]butyl]isoindoline-1,3-quinone Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3C=C(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3C=C(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O4/c26-20-17-5-1-2-6-18(17)21(27)24(20)12-4-3-11-23-13-19(22-14-23)15-7-9-16(10-8-15)25(28)29/h1-2,5-10,13-14H,3-4,11-12H2