N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-1-esyl-isonipecotamide Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23ClN2O4S/c1-2-29(27,28)24-12-10-16(11-13-24)21(26)23-19-9-8-17(22)14-18(19)20(25)15-6-4-3-5-7-15/h3-9,14,16H,2,10-13H2,1H3,(H,23,26)