1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(2,4,6-trimethylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide Traditional Name: N-mesityl-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C22H27N3O5S/c1-14-11-16(3)21(17(4)12-14)23-22(26)18-7-9-24(10-8-18)31(29,30)20-13-19(25(27)28)6-5-15(20)2/h5-6,11-13,18H,7-10H2,1-4H3,(H,23,26)