4-[2-[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)ethanoyl]hydrazinyl]benzenesulfonamide

Systemtic Name: 4-[2-[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)ethanoyl]hydrazinyl]benzenesulfonamide Openeye Name: 4-[2-[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)acetyl]hydrazino]benzenesulfonamide CAS Name: 4-[[2-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)-1-oxoethyl]hydrazo]benzenesulfonamide IUPAC Name: 4-[2-[2-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)acetyl]hydrazinyl]benzenesulfonamide Traditional Name: 4-[N'-[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)acetyl]hydrazino]benzenesulfonamide Formula: C21H23N4O3S+ MolecularWeight: 411.49732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CC(=O)NNC2=CC=C(C=C2)S(=O)(=O)N)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=[N+]1CC(=O)NNC2=CC=C(C=C2)S(=O)(=O)N)C)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S/c1-15-12-18(17-6-4-3-5-7-17)13-16(2)25(15)14-21(26)24-23-19-8-10-20(11-9-19)29(22,27)28/h3-13,23H,14H2,1-2H3,(H2-,22,24,26,27,28)/p+1