N-(4-acetamidophenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide CAS Name: N-(4-acetamidophenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-(2,4-dichlorobenzyl)sulfonyl-nipecotamide Formula: C21H23Cl2N3O4S MolecularWeight: 484.39602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O4S/c1-14(27)24-18-6-8-19(9-7-18)25-21(28)15-3-2-10-26(12-15)31(29,30)13-16-4-5-17(22)11-20(16)23/h4-9,11,15H,2-3,10,12-13H2,1H3,(H,24,27)(H,25,28)