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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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