N-[(Z)-5-methylhexan-2-ylideneamino]-4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]benzamide

Systemtic Name: N-[(Z)-5-methylhexan-2-ylideneamino]-4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]benzamide Openeye Name: N-[(Z)-1,4-dimethylpentylideneamino]-4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]benzamide CAS Name: N-[(Z)-5-methylhexan-2-ylideneamino]-4-[methyl-(1-methyl-4-piperidin-1-iumyl)sulfamoyl]benzamide IUPAC Name: N-[(Z)-5-methylhexan-2-ylideneamino]-4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]benzamide Traditional Name: N-[(Z)-1,4-dimethylpentylideneamino]-4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]benzamide Formula: C21H35N4O3S+ MolecularWeight: 423.5926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=NNC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C2CC[NH+](CC2)C)C

Isomeric SMILES

CC(C)CC/C(=N\NC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C2CC[NH+](CC2)C)/C

InChI

InChI=1S/C21H34N4O3S/c1-16(2)6-7-17(3)22-23-21(26)18-8-10-20(11-9-18)29(27,28)25(5)19-12-14-24(4)15-13-19/h8-11,16,19H,6-7,12-15H2,1-5H3,(H,23,26)/p+1/b22-17-