N-(5-chloranyl-2-methyl-phenyl)-2-(4-morpholin-4-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-(4-morpholin-4-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-(4-morpholinosulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[4-(4-morpholinylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-(4-morpholin-4-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-(4-morpholinosulfonylpiperazin-1-ium-1-yl)acetamide Formula: C17H26ClN4O4S+ MolecularWeight: 417.93074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H25ClN4O4S/c1-14-2-3-15(18)12-16(14)19-17(23)13-20-4-6-21(7-5-20)27(24,25)22-8-10-26-11-9-22/h2-3,12H,4-11,13H2,1H3,(H,19,23)/p+1