N-[4-chloranyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]-4-(1,3-oxazol-5-yl)benzenesulfonamide

Systemtic Name: N-[4-chloranyl-2-(1-oxidanidylpyridin-1-ium-4-yl)carbonyl-phenyl]-4-(1,3-oxazol-5-yl)benzenesulfonamide Openeye Name: N-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-oxazol-5-yl-benzenesulfonamide CAS Name: N-[4-chloro-2-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]phenyl]-4-(5-oxazolyl)benzenesulfonamide IUPAC Name: N-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-(1,3-oxazol-5-yl)benzenesulfonamide Traditional Name: N-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-oxazol-5-yl-benzenesulfonamide Formula: C21H14ClN3O5S MolecularWeight: 455.87096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=CO2)S(=O)(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CN=CO2)S(=O)(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C21H14ClN3O5S/c22-16-3-6-19(18(11-16)21(26)15-7-9-25(27)10-8-15)24-31(28,29)17-4-1-14(2-5-17)20-12-23-13-30-20/h1-13,24H