3-[[4-[(3R)-1-prop-2-enylsulfonylpyrrolidin-3-yl]piperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 3-[[4-[(3R)-1-prop-2-enylsulfonylpyrrolidin-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 3-[[4-[(3R)-1-allylsulfonylpyrrolidin-3-yl]piperidin-1-ium-1-yl]methyl]pyridine CAS Name: 3-[[4-[(3R)-1-prop-2-enylsulfonyl-3-pyrrolidinyl]-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 3-[[4-[(3R)-1-prop-2-enylsulfonylpyrrolidin-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 3-[[4-[(3R)-1-allylsulfonylpyrrolidin-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

C=CCS(=O)(=O)N1CCC(C1)C2CC[NH+](CC2)CC3=CN=CC=C3

Isomeric SMILES

C=CCS(=O)(=O)N1CC[C@@H](C1)C2CC[NH+](CC2)CC3=CN=CC=C3

InChI

InChI=1S/C18H27N3O2S/c1-2-12-24(22,23)21-11-7-18(15-21)17-5-9-20(10-6-17)14-16-4-3-8-19-13-16/h2-4,8,13,17-18H,1,5-7,9-12,14-15H2/p+1/t18-/m0/s1