N-[4-chloranyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]-4-(2-methyl-1-oxidanyl-propan-2-yl)benzenesulfonamide

Systemtic Name: N-[4-chloranyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]-4-(2-methyl-1-oxidanyl-propan-2-yl)benzenesulfonamide Openeye Name: N-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-(2-hydroxy-1,1-dimethyl-ethyl)benzenesulfonamide CAS Name: N-[4-chloro-2-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]phenyl]-4-(1-hydroxy-2-methylpropan-2-yl)benzenesulfonamide IUPAC Name: N-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-(1-hydroxy-2-methylpropan-2-yl)benzenesulfonamide Traditional Name: N-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-(2-hydroxy-1,1-dimethyl-ethyl)benzenesulfonamide Formula: C22H21ClN2O5S MolecularWeight: 460.93054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

CC(C)(CO)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C22H21ClN2O5S/c1-22(2,14-26)16-3-6-18(7-4-16)31(29,30)24-20-8-5-17(23)13-19(20)21(27)15-9-11-25(28)12-10-15/h3-13,24,26H,14H2,1-2H3