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2-[3-(4-nitrophenyl)carbonyloxypropyl]-3H-benzimidazole-5-carboxylate
2-[3-(4-nitrophenyl)carbonyloxypropyl]-3H-benzimidazole-5-carboxylate
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1C(=O)OCCCC2=NC3=C(N2)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]
Isomeric SMILES
C1=CC(=CC=C1C(=O)OCCCC2=NC3=C(N2)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C18H15N3O6/c22-17(23)12-5-8-14-15(10-12)20-16(19-14)2-1-9-27-18(24)11-3-6-13(7-4-11)21(25)26/h3-8,10H,1-2,9H2,(H,19,20)(H,22,23)/p-1
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