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1-(2,4-dimethylphenyl)sulfonyl-N-methyl-N-[1-(3-nitrophenyl)ethyl]piperidine-4-carboxamide
1-(2,4-dimethylphenyl)sulfonyl-N-methyl-N-[1-(3-nitrophenyl)ethyl]piperidine-4-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-])C
Isomeric SMILES
CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-])C
InChI
InChI=1S/C23H29N3O5S/c1-16-8-9-22(17(2)14-16)32(30,31)25-12-10-19(11-13-25)23(27)24(4)18(3)20-6-5-7-21(15-20)26(28)29/h5-9,14-15,18-19H,10-13H2,1-4H3
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