N-[2-(4-chloranylphenoxy)ethyl]-N-methyl-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[2-(4-chloranylphenoxy)ethyl]-N-methyl-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[2-(4-chlorophenoxy)ethyl]-N-methyl-5-(1-piperidylsulfonyl)pyridin-1-ium-2-amine CAS Name: N-[2-(4-chlorophenoxy)ethyl]-N-methyl-5-(1-piperidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[2-(4-chlorophenoxy)ethyl]-N-methyl-5-piperidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: 2-(4-chlorophenoxy)ethyl-methyl-(5-piperidinosulfonylpyridin-1-ium-2-yl)amine Formula: C19H25ClN3O3S+ MolecularWeight: 410.9381

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Cl)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Cl)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H24ClN3O3S/c1-22(13-14-26-17-7-5-16(20)6-8-17)19-10-9-18(15-21-19)27(24,25)23-11-3-2-4-12-23/h5-10,15H,2-4,11-14H2,1H3/p+1