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1-[(1R,3S)-3-methylcyclohexyl]-4-(4-nitrophenyl)sulfonyl-piperazin-1-ium
1-[(1R,3S)-3-methylcyclohexyl]-4-(4-nitrophenyl)sulfonyl-piperazin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
CC1CCCC(C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Isomeric SMILES
C[C@H]1CCC[C@H](C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C17H25N3O4S/c1-14-3-2-4-16(13-14)18-9-11-19(12-10-18)25(23,24)17-7-5-15(6-8-17)20(21)22/h5-8,14,16H,2-4,9-13H2,1H3/p+1/t14-,16+/m0/s1
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