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1,7-bis(6-oxidanyl-1H-benzimidazol-2-yl)heptane-1,4,7-trione

1,7-bis(6-oxidanyl-1H-benzimidazol-2-yl)heptane-1,4,7-trione

Systemtic Name:1,7-bis(6-oxidanyl-1H-benzimidazol-2-yl)heptane-1,4,7-trione
Openeye Name:1,7-bis(6-hydroxy-1H-benzimidazol-2-yl)heptane-1,4,7-trione
CAS Name:1,7-bis(6-hydroxy-1H-benzimidazol-2-yl)heptane-1,4,7-trione
IUPAC Name:1,7-bis(6-hydroxy-1H-benzimidazol-2-yl)heptane-1,4,7-trione
Traditional Name:1,7-bis(6-hydroxy-1H-benzimidazol-2-yl)heptane-1,4,7-trione
Formula: C21H18N4O5
MolecularWeight: 406.39142
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)NC(=N2)C(=O)CCC(=O)CCC(=O)C3=NC4=C(N3)C=C(C=C4)O


Isomeric SMILES

C1=CC2=C(C=C1O)NC(=N2)C(=O)CCC(=O)CCC(=O)C3=NC4=C(N3)C=C(C=C4)O


InChI

InChI=1S/C21H18N4O5/c26-11(3-7-18(29)20-22-14-5-1-12(27)9-16(14)24-20)4-8-19(30)21-23-15-6-2-13(28)10-17(15)25-21/h1-2,5-6,9-10,27-28H,3-4,7-8H2,(H,22,24)(H,23,25)


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