N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C28H29ClN2O4S MolecularWeight: 525.05886

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C28H29ClN2O4S/c29-24-13-14-26(25(20-24)27(32)22-11-5-2-6-12-22)30-28(33)23-15-17-31(18-16-23)36(34,35)19-7-10-21-8-3-1-4-9-21/h1-6,8-9,11-14,20,23H,7,10,15-19H2,(H,30,33)