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

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide CAS Name: N-(5-chloro-2-phenoxyphenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-1-(2,4-dichlorobenzyl)sulfonyl-nipecotamide Formula: C25H23Cl3N2O4S MolecularWeight: 553.88512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C4

InChI

InChI=1S/C25H23Cl3N2O4S/c26-19-9-8-18(22(28)13-19)16-35(32,33)30-12-4-5-17(15-30)25(31)29-23-14-20(27)10-11-24(23)34-21-6-2-1-3-7-21/h1-3,6-11,13-14,17H,4-5,12,15-16H2,(H,29,31)