N-[[(2S)-oxolan-2-yl]methyl]-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[[(2S)-oxolan-2-yl]methyl]-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: 5-(1-piperidylsulfonyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyridin-1-ium-2-amine CAS Name: N-[[(2S)-2-oxolanyl]methyl]-5-(1-piperidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[[(2S)-oxolan-2-yl]methyl]-5-piperidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: (5-piperidinosulfonylpyridin-1-ium-2-yl)-[[(2S)-tetrahydrofuran-2-yl]methyl]amine Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCC3CCCO3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C[NH+]=C(C=C2)NC[C@@H]3CCCO3

InChI

InChI=1S/C15H23N3O3S/c19-22(20,18-8-2-1-3-9-18)14-6-7-15(17-12-14)16-11-13-5-4-10-21-13/h6-7,12-13H,1-5,8-11H2,(H,16,17)/p+1/t13-/m0/s1