N-(3-chloranyl-2-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C19H22Cl2N3O3S+ MolecularWeight: 443.36728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21Cl2N3O3S/c1-14-17(21)3-2-4-18(14)22-19(25)13-23-9-11-24(12-10-23)28(26,27)16-7-5-15(20)6-8-16/h2-8H,9-13H2,1H3,(H,22,25)/p+1