4-[2-[4-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[4-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(5-chloro-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-(5-chloro-2-methoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(5-chloro-2-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-(5-chloro-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C20H24ClN4O5S+ MolecularWeight: 467.94636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H23ClN4O5S/c1-30-17-7-4-15(21)12-18(17)31(28,29)25-10-8-24(9-11-25)13-19(26)23-16-5-2-14(3-6-16)20(22)27/h2-7,12H,8-11,13H2,1H3,(H2,22,27)(H,23,26)/p+1