2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: N-(3-mesylphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C15H23N2O3S+ MolecularWeight: 311.41972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H22N2O3S/c1-12-5-4-8-17(10-12)11-15(18)16-13-6-3-7-14(9-13)21(2,19)20/h3,6-7,9,12H,4-5,8,10-11H2,1-2H3,(H,16,18)/p+1/t12-/m0/s1