N-(3-chloranyl-2,6-diethyl-phenyl)-2-[4-(methylsulfonylamino)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-[4-(methylsulfonylamino)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[4-(methanesulfonamido)piperidin-1-ium-1-yl]acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-[4-(methanesulfonamido)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-[4-(methanesulfonamido)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[4-(methanesulfonamido)piperidin-1-ium-1-yl]acetamide Formula: C18H29ClN3O3S+ MolecularWeight: 402.95916

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C[NH+]2CCC(CC2)NS(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C[NH+]2CCC(CC2)NS(=O)(=O)C

InChI

InChI=1S/C18H28ClN3O3S/c1-4-13-6-7-16(19)15(5-2)18(13)20-17(23)12-22-10-8-14(9-11-22)21-26(3,24)25/h6-7,14,21H,4-5,8-12H2,1-3H3,(H,20,23)/p+1