N-methyl-N-(phenylmethyl)-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-methyl-N-(phenylmethyl)-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-benzyl-N-methyl-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine CAS Name: N-methyl-N-(phenylmethyl)-5-(1-pyrrolidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-benzyl-N-methyl-5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: benzyl-methyl-(5-pyrrolidinosulfonylpyridin-1-ium-2-yl)amine Formula: C17H22N3O2S+ MolecularWeight: 332.44048

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H21N3O2S/c1-19(14-15-7-3-2-4-8-15)17-10-9-16(13-18-17)23(21,22)20-11-5-6-12-20/h2-4,7-10,13H,5-6,11-12,14H2,1H3/p+1