1-(4-methylsulfonyl-2-nitro-phenyl)-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-(4-methylsulfonyl-2-nitro-phenyl)-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-(4-methylsulfonyl-2-nitro-phenyl)-N-phenyl-piperidine-4-carboxamide CAS Name: 1-(4-methylsulfonyl-2-nitrophenyl)-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-(4-methylsulfonyl-2-nitrophenyl)-N-phenylpiperidine-4-carboxamide Traditional Name: 1-(4-mesyl-2-nitro-phenyl)-N-phenyl-isonipecotamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S/c1-28(26,27)16-7-8-17(18(13-16)22(24)25)21-11-9-14(10-12-21)19(23)20-15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3,(H,20,23)