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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O4S/c1-14(27)24-17-3-5-18(6-4-17)25-21(28)16-8-10-26(11-9-16)31(29,30)13-15-2-7-19(22)20(23)12-15/h2-7,12,16H,8-11,13H2,1H3,(H,24,27)(H,25,28)