N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-1-mesyl-isonipecotamide Formula: C19H19Cl2N3O6S MolecularWeight: 488.34166

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC(=CC(=C2)OC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC(=CC(=C2)OC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19Cl2N3O6S/c1-31(28,29)23-6-4-12(5-7-23)19(25)22-14-9-15(24(26)27)11-16(10-14)30-18-3-2-13(20)8-17(18)21/h2-3,8-12H,4-7H2,1H3,(H,22,25)