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diethyl-[3-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]propyl]azanium
diethyl-[3-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]propyl]azanium
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Descriptors Computed from Structure
Canonical SMILES:
CC[NH+](CC)CCCNC(=O)C1=CC(=C(C=C1)N2CCCCC2)[N+](=O)[O-]
Isomeric SMILES
CC[NH+](CC)CCCNC(=O)C1=CC(=C(C=C1)N2CCCCC2)[N+](=O)[O-]
InChI
InChI=1S/C19H30N4O3/c1-3-21(4-2)12-8-11-20-19(24)16-9-10-17(18(15-16)23(25)26)22-13-6-5-7-14-22/h9-10,15H,3-8,11-14H2,1-2H3,(H,20,24)/p+1
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- (2-cyanophenyl) 3-nitro-4-piperidin-1-yl-benzoate
