1-ethylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-ethylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-ethylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-ethylsulfonyl-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-ethylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-esyl-N-[2-(pyrrolidinomethyl)benzyl]isonipecotamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C20H31N3O3S/c1-2-27(25,26)23-13-9-17(10-14-23)20(24)21-15-18-7-3-4-8-19(18)16-22-11-5-6-12-22/h3-4,7-8,17H,2,5-6,9-16H2,1H3,(H,21,24)