N-(5-chloranyl-2-methyl-phenyl)-2-[4-(4-methylpiperidin-1-yl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[4-(4-methylpiperidin-1-yl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[4-[(4-methyl-1-piperidyl)sulfonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[4-[(4-methyl-1-piperidinyl)sulfonyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[4-(4-methylpiperidin-1-yl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[4-(4-methylpiperidino)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C19H30ClN4O3S+ MolecularWeight: 429.9845

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C19H29ClN4O3S/c1-15-5-7-23(8-6-15)28(26,27)24-11-9-22(10-12-24)14-19(25)21-18-13-17(20)4-3-16(18)2/h3-4,13,15H,5-12,14H2,1-2H3,(H,21,25)/p+1