N-prop-2-ynyl-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-prop-2-ynyl-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-prop-2-ynyl-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine CAS Name: N-prop-2-ynyl-5-(1-pyrrolidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-prop-2-ynyl-5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: propargyl-(5-pyrrolidinosulfonylpyridin-1-ium-2-yl)amine Formula: C12H16N3O2S+ MolecularWeight: 266.33934

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

C#CCNC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C12H15N3O2S/c1-2-7-13-12-6-5-11(10-14-12)18(16,17)15-8-3-4-9-15/h1,5-6,10H,3-4,7-9H2,(H,13,14)/p+1