N-[4-chloranyl-2-[(E)-N-oxidanyl-C-phenyl-carbonimidoyl]phenyl]octane-1-sulfonamide

Systemtic Name: N-[4-chloranyl-2-[(E)-N-oxidanyl-C-phenyl-carbonimidoyl]phenyl]octane-1-sulfonamide Openeye Name: N-[4-chloro-2-[(E)-N-hydroxy-C-phenyl-carbonimidoyl]phenyl]octane-1-sulfonamide CAS Name: N-[4-chloro-2-[(E)-hydroxyimino(phenyl)methyl]phenyl]-1-octanesulfonamide IUPAC Name: N-[4-chloro-2-[(E)-N-hydroxy-C-phenylcarbonimidoyl]phenyl]octane-1-sulfonamide Traditional Name: N-[4-chloro-2-[(E)-phenylcarbohydroximoyl]phenyl]octane-1-sulfonamide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)NC1=C(C=C(C=C1)Cl)C(=NO)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCS(=O)(=O)NC1=C(C=C(C=C1)Cl)/C(=N/O)/C2=CC=CC=C2

InChI

InChI=1S/C21H27ClN2O3S/c1-2-3-4-5-6-10-15-28(26,27)24-20-14-13-18(22)16-19(20)21(23-25)17-11-8-7-9-12-17/h7-9,11-14,16,24-25H,2-6,10,15H2,1H3/b23-21+