N,N-dimethyl-5-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N,N-dimethyl-5-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-pyridin-1-ium-2-amine Openeye Name: 5-[(4-benzyl-1-piperidyl)sulfonyl]-N,N-dimethyl-pyridin-1-ium-2-amine CAS Name: N,N-dimethyl-5-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-2-pyridin-1-iumamine IUPAC Name: 5-(4-benzylpiperidin-1-yl)sulfonyl-N,N-dimethylpyridin-1-ium-2-amine Traditional Name: [5-(4-benzylpiperidino)sulfonylpyridin-1-ium-2-yl]-dimethyl-amine Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=[NH+]C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=[NH+]C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O2S/c1-21(2)19-9-8-18(15-20-19)25(23,24)22-12-10-17(11-13-22)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3/p+1