N-(2-methyl-5-nitro-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-5-nitrophenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-1-tosyl-isonipecotamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O5S/c1-14-3-7-18(8-4-14)29(27,28)22-11-9-16(10-12-22)20(24)21-19-13-17(23(25)26)6-5-15(19)2/h3-8,13,16H,9-12H2,1-2H3,(H,21,24)