[1-(1,3-benzodioxol-5-ylsulfonyl)-4-oxidanyl-piperidin-4-yl]methylazanium

Systemtic Name: [1-(1,3-benzodioxol-5-ylsulfonyl)-4-oxidanyl-piperidin-4-yl]methylazanium Openeye Name: [1-(1,3-benzodioxol-5-ylsulfonyl)-4-hydroxy-4-piperidyl]methylammonium CAS Name: [1-(1,3-benzodioxol-5-ylsulfonyl)-4-hydroxy-4-piperidinyl]methylammonium IUPAC Name: [1-(1,3-benzodioxol-5-ylsulfonyl)-4-hydroxypiperidin-4-yl]methylazanium Traditional Name: [1-(1,3-benzodioxol-5-ylsulfonyl)-4-hydroxy-4-piperidyl]methylammonium Formula: C13H19N2O5S+ MolecularWeight: 315.36536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C[NH3+])O)S(=O)(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CN(CCC1(C[NH3+])O)S(=O)(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H18N2O5S/c14-8-13(16)3-5-15(6-4-13)21(17,18)10-1-2-11-12(7-10)20-9-19-11/h1-2,7,16H,3-6,8-9,14H2/p+1