4-chloranyl-N'-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]benzohydrazide

Systemtic Name: 4-chloranyl-N'-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]benzohydrazide Openeye Name: 4-chloro-N'-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]benzohydrazide CAS Name: 4-chloro-N'-[2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]benzohydrazide IUPAC Name: 4-chloro-N'-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]benzohydrazide Traditional Name: 4-chloro-N'-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]benzohydrazide Formula: C21H26ClN4O4S+ MolecularWeight: 465.97354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NNC(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NNC(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H25ClN4O4S/c1-15-3-8-19(13-16(15)2)31(29,30)26-11-9-25(10-12-26)14-20(27)23-24-21(28)17-4-6-18(22)7-5-17/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)(H,24,28)/p+1