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6-[2-(3-nitro-4-oxidanyl-phenyl)ethylamino]-1H-benzimidazole-4,7-dione

6-[2-(3-nitro-4-oxidanyl-phenyl)ethylamino]-1H-benzimidazole-4,7-dione

Systemtic Name:6-[2-(3-nitro-4-oxidanyl-phenyl)ethylamino]-1H-benzimidazole-4,7-dione
Openeye Name:6-[2-(4-hydroxy-3-nitro-phenyl)ethylamino]-1H-benzimidazole-4,7-dione
CAS Name:6-[2-(4-hydroxy-3-nitrophenyl)ethylamino]-1H-benzimidazole-4,7-dione
IUPAC Name:6-[2-(4-hydroxy-3-nitrophenyl)ethylamino]-1H-benzimidazole-4,7-dione
Traditional Name:6-[2-(4-hydroxy-3-nitro-phenyl)ethylamino]-1H-benzimidazole-4,7-quinone
Formula: C15H12N4O5
MolecularWeight: 328.27958
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCNC2=CC(=O)C3=C(C2=O)NC=N3)[N+](=O)[O-])O


Isomeric SMILES

C1=CC(=C(C=C1CCNC2=CC(=O)C3=C(C2=O)NC=N3)[N+](=O)[O-])O


InChI

InChI=1S/C15H12N4O5/c20-11-2-1-8(5-10(11)19(23)24)3-4-16-9-6-12(21)13-14(15(9)22)18-7-17-13/h1-2,5-7,16,20H,3-4H2,(H,17,18)


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