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2-[(3-nitro-4-pentoxy-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium
2-[(3-nitro-4-pentoxy-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCOC1=C(C=C(C=C1)CSC2=[NH+]CCN2)[N+](=O)[O-]
Isomeric SMILES
CCCCCOC1=C(C=C(C=C1)CSC2=[NH+]CCN2)[N+](=O)[O-]
InChI
InChI=1S/C15H21N3O3S/c1-2-3-4-9-21-14-6-5-12(10-13(14)18(19)20)11-22-15-16-7-8-17-15/h5-6,10H,2-4,7-9,11H2,1H3,(H,16,17)/p+1
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