4-methyl-N'-[1-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzenesulfonohydrazide

Systemtic Name: 4-methyl-N'-[1-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzenesulfonohydrazide Openeye Name: 4-methyl-N'-[1-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzenesulfonohydrazide CAS Name: 4-methyl-N'-[1-[4-oxo-3-(1-piperidin-1-iumylmethyl)-1-cyclohexa-2,5-dienylidene]ethyl]benzenesulfonohydrazide IUPAC Name: 4-methyl-N'-[1-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzenesulfonohydrazide Traditional Name: N'-[1-[4-keto-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]-4-methyl-benzenesulfonohydrazide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC(=C2C=CC(=O)C(=C2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC(=C2C=CC(=O)C(=C2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C21H27N3O3S/c1-16-6-9-20(10-7-16)28(26,27)23-22-17(2)18-8-11-21(25)19(14-18)15-24-12-4-3-5-13-24/h6-11,14,22-23H,3-5,12-13,15H2,1-2H3/p+1