N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-1-(2,4-dichlorobenzyl)sulfonyl-isonipecotamide Formula: C21H23Cl3N2O5S MolecularWeight: 521.84172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl)OC)Cl

InChI

InChI=1S/C21H23Cl3N2O5S/c1-30-19-11-18(20(31-2)10-17(19)24)25-21(27)13-5-7-26(8-6-13)32(28,29)12-14-3-4-15(22)9-16(14)23/h3-4,9-11,13H,5-8,12H2,1-2H3,(H,25,27)