1-(phenylmethyl)-N'-(2,4,6-trimethylphenyl)sulfonyl-piperidin-1-ium-4-carbohydrazide

Systemtic Name: 1-(phenylmethyl)-N'-(2,4,6-trimethylphenyl)sulfonyl-piperidin-1-ium-4-carbohydrazide Openeye Name: 1-benzyl-N'-(2,4,6-trimethylphenyl)sulfonyl-piperidin-1-ium-4-carbohydrazide CAS Name: 1-(phenylmethyl)-N'-(2,4,6-trimethylphenyl)sulfonyl-4-piperidin-1-iumcarbohydrazide IUPAC Name: 1-benzyl-N'-(2,4,6-trimethylphenyl)sulfonylpiperidin-1-ium-4-carbohydrazide Traditional Name: 1-benzyl-N'-mesitylsulfonyl-piperidin-1-ium-4-carbohydrazide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NNC(=O)C2CC[NH+](CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NNC(=O)C2CC[NH+](CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H29N3O3S/c1-16-13-17(2)21(18(3)14-16)29(27,28)24-23-22(26)20-9-11-25(12-10-20)15-19-7-5-4-6-8-19/h4-8,13-14,20,24H,9-12,15H2,1-3H3,(H,23,26)/p+1