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

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C20H24Cl2N3O4S+ MolecularWeight: 473.39326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23Cl2N3O4S/c1-14-11-18(19(29-2)12-17(14)22)23-20(26)13-24-7-9-25(10-8-24)30(27,28)16-5-3-15(21)4-6-16/h3-6,11-12H,7-10,13H2,1-2H3,(H,23,26)/p+1