N-methyl-N-(2-phenoxyethyl)-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-methyl-N-(2-phenoxyethyl)-5-piperidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-methyl-N-(2-phenoxyethyl)-5-(1-piperidylsulfonyl)pyridin-1-ium-2-amine CAS Name: N-methyl-N-(2-phenoxyethyl)-5-(1-piperidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-methyl-N-(2-phenoxyethyl)-5-piperidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: methyl-(2-phenoxyethyl)-(5-piperidinosulfonylpyridin-1-ium-2-yl)amine Formula: C19H26N3O3S+ MolecularWeight: 376.49304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O3S/c1-21(14-15-25-17-8-4-2-5-9-17)19-11-10-18(16-20-19)26(23,24)22-12-6-3-7-13-22/h2,4-5,8-11,16H,3,6-7,12-15H2,1H3/p+1