1-ethylsulfonyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,2,3-triazol-1-yl]methyl]piperidine

Systemtic Name: 1-ethylsulfonyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,2,3-triazol-1-yl]methyl]piperidine Openeye Name: 1-ethylsulfonyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)triazol-1-yl]methyl]piperidine CAS Name: 1-ethylsulfonyl-4-[[4-(1-pyrrolidin-1-iumylmethyl)-1-triazolyl]methyl]piperidine IUPAC Name: 1-ethylsulfonyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)triazol-1-yl]methyl]piperidine Traditional Name: 1-esyl-4-[[4-(pyrrolidin-1-ium-1-ylmethyl)triazol-1-yl]methyl]piperidine Formula: C15H28N5O2S+ MolecularWeight: 342.48012

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)CN2C=C(N=N2)C[NH+]3CCCC3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)CN2C=C(N=N2)C[NH+]3CCCC3

InChI

InChI=1S/C15H27N5O2S/c1-2-23(21,22)20-9-5-14(6-10-20)11-19-13-15(16-17-19)12-18-7-3-4-8-18/h13-14H,2-12H2,1H3/p+1