3-methylsulfonyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]benzamide

Systemtic Name: 3-methylsulfonyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]benzamide Openeye Name: 3-methylsulfonyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]benzamide CAS Name: 3-methylsulfonyl-N-[2-[(2R)-2-piperidin-1-iumyl]ethyl]benzamide IUPAC Name: 3-methylsulfonyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]benzamide Traditional Name: 3-mesyl-N-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]benzamide Formula: C15H23N2O3S+ MolecularWeight: 311.41972

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NCCC2CCCC[NH2+]2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NCC[C@H]2CCCC[NH2+]2

InChI

InChI=1S/C15H22N2O3S/c1-21(19,20)14-7-4-5-12(11-14)15(18)17-10-8-13-6-2-3-9-16-13/h4-5,7,11,13,16H,2-3,6,8-10H2,1H3,(H,17,18)/p+1/t13-/m1/s1