4-(3-methylsulfonylphenyl)-1,2,3,6-tetrahydropyridin-1-ium

Systemtic Name: 4-(3-methylsulfonylphenyl)-1,2,3,6-tetrahydropyridin-1-ium Openeye Name: 4-(3-methylsulfonylphenyl)-1,2,3,6-tetrahydropyridin-1-ium CAS Name: 4-(3-methylsulfonylphenyl)-1,2,3,6-tetrahydropyridin-1-ium IUPAC Name: 4-(3-methylsulfonylphenyl)-1,2,3,6-tetrahydropyridin-1-ium Traditional Name: 4-(3-mesylphenyl)-1,2,3,6-tetrahydropyridin-1-ium Formula: C12H16NO2S+ MolecularWeight: 238.32594

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=CC[NH2+]CC2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=CC[NH2+]CC2

InChI

InChI=1S/C12H15NO2S/c1-16(14,15)12-4-2-3-11(9-12)10-5-7-13-8-6-10/h2-5,9,13H,6-8H2,1H3/p+1