4-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidin-1-ium

Systemtic Name: 4-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidin-1-ium Openeye Name: 4-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidin-1-ium CAS Name: 4-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]piperidin-1-ium IUPAC Name: 4-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidin-1-ium Traditional Name: 4-(4-pyrrolidinosulfonylbenzyl)piperidin-1-ium Formula: C16H25N2O2S+ MolecularWeight: 309.4469

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CC3CC[NH2+]CC3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CC3CC[NH2+]CC3

InChI

InChI=1S/C16H24N2O2S/c19-21(20,18-11-1-2-12-18)16-5-3-14(4-6-16)13-15-7-9-17-10-8-15/h3-6,15,17H,1-2,7-13H2/p+1