1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-[3-(3-methylphenyl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-[3-(3-methylphenyl)propyl]piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-N-[3-(m-tolyl)propyl]piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-[3-(3-methylphenyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-[3-(3-methylphenyl)propyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)sulfonyl-N-[3-(m-tolyl)propyl]isonipecotamide Formula: C23H28ClFN2O3S MolecularWeight: 466.996423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC(=CC=C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C23H28ClFN2O3S/c1-17-5-2-6-18(15-17)7-4-12-26-23(28)19-10-13-27(14-11-19)31(29,30)16-20-21(24)8-3-9-22(20)25/h2-3,5-6,8-9,15,19H,4,7,10-14,16H2,1H3,(H,26,28)