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1-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium
1-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC
Isomeric SMILES
COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC
InChI
InChI=1S/C20H25N3O5/c1-26-18-7-5-4-6-16(18)22-10-8-21(9-11-22)14-15-12-19(27-2)20(28-3)13-17(15)23(24)25/h4-7,12-13H,8-11,14H2,1-3H3/p+1
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