N-[(2S)-1-[(4-methylphenyl)sulfonylamino]propan-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(2S)-1-[(4-methylphenyl)sulfonylamino]propan-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[(1S)-1-methyl-2-(p-tolylsulfonylamino)ethyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[(2S)-1-[(4-methylphenyl)sulfonylamino]propan-2-yl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[(2S)-1-[(4-methylphenyl)sulfonylamino]propan-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[(1S)-1-methyl-2-(tosylamino)ethyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(C)NC(=O)C[NH+]2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC[C@H](C)NC(=O)C[NH+]2CCCCC2

InChI

InChI=1S/C17H27N3O3S/c1-14-6-8-16(9-7-14)24(22,23)18-12-15(2)19-17(21)13-20-10-4-3-5-11-20/h6-9,15,18H,3-5,10-13H2,1-2H3,(H,19,21)/p+1/t15-/m0/s1