1-methyl-4-(6-pyrrolidin-1-ylpyridin-3-yl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-methyl-4-(6-pyrrolidin-1-ylpyridin-3-yl)sulfonyl-piperazin-1-ium Openeye Name: 1-methyl-4-[(6-pyrrolidin-1-yl-3-pyridyl)sulfonyl]piperazin-1-ium CAS Name: 1-methyl-4-[[6-(1-pyrrolidinyl)-3-pyridinyl]sulfonyl]piperazin-1-ium IUPAC Name: 1-methyl-4-(6-pyrrolidin-1-ylpyridin-3-yl)sulfonylpiperazin-1-ium Traditional Name: 1-methyl-4-[(6-pyrrolidino-3-pyridyl)sulfonyl]piperazin-1-ium Formula: C14H23N4O2S+ MolecularWeight: 311.42302

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C14H22N4O2S/c1-16-8-10-18(11-9-16)21(19,20)13-4-5-14(15-12-13)17-6-2-3-7-17/h4-5,12H,2-3,6-11H2,1H3/p+1