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2-[[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]amino]-N-tert-butyl-ethanamide
2-[[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]amino]-N-tert-butyl-ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)(C)NC(=O)CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)[N+](=O)[O-]
Isomeric SMILES
CC(C)(C)NC(=O)CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)[N+](=O)[O-]
InChI
InChI=1S/C18H28N4O5S/c1-18(2,3)20-17(23)13-19-15-9-8-14(12-16(15)22(24)25)28(26,27)21-10-6-4-5-7-11-21/h8-9,12,19H,4-7,10-11,13H2,1-3H3,(H,20,23)
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- N-tert-butyl-2-[[4-(tert-butylsulfamoyl)-2-nitro-phenyl]amino]ethanamide
