N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-(2-chloro-6-fluoro-benzyl)-1-(4-methoxyphenyl)sulfonyl-N-methyl-isonipecotamide Formula: C21H24ClFN2O4S MolecularWeight: 454.942663

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24ClFN2O4S/c1-24(14-18-19(22)4-3-5-20(18)23)21(26)15-10-12-25(13-11-15)30(27,28)17-8-6-16(29-2)7-9-17/h3-9,15H,10-14H2,1-2H3