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

Systemtic Name: 1-(4-cyanophenyl)sulfonyl-N-(2-methyl-5-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-(4-cyanophenyl)sulfonyl-N-(2-methyl-5-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-(4-cyanophenyl)sulfonyl-N-(2-methyl-5-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-cyanophenyl)sulfonyl-N-(2-methyl-5-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(4-cyanophenyl)sulfonyl-N-(2-methyl-5-nitro-phenyl)isonipecotamide Formula: C20H20N4O5S MolecularWeight: 428.4616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N4O5S/c1-14-2-5-17(24(26)27)12-19(14)22-20(25)16-8-10-23(11-9-16)30(28,29)18-6-3-15(13-21)4-7-18/h2-7,12,16H,8-11H2,1H3,(H,22,25)