N'-(3,3-dimethylbutanoyl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzohydrazide

Systemtic Name: N'-(3,3-dimethylbutanoyl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzohydrazide Openeye Name: N'-(3,3-dimethylbutanoyl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzohydrazide CAS Name: N'-(3,3-dimethyl-1-oxobutyl)-4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzohydrazide IUPAC Name: N'-(3,3-dimethylbutanoyl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzohydrazide Traditional Name: N'-(3,3-dimethylbutanoyl)-4-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzohydrazide Formula: C18H29N4O4S+ MolecularWeight: 397.51226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O4S/c1-18(2,3)13-16(23)19-20-17(24)14-5-7-15(8-6-14)27(25,26)22-11-9-21(4)10-12-22/h5-8H,9-13H2,1-4H3,(H,19,23)(H,20,24)/p+1