4-cyano-N-[3-[1-(2-oxidanyl-4-oxidanylidene-5,6,7,8-tetrahydrochromen-3-yl)propyl]phenyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[3-[1-(2-oxidanyl-4-oxidanylidene-5,6,7,8-tetrahydrochromen-3-yl)propyl]phenyl]benzenesulfonamide Openeye Name: 4-cyano-N-[3-[1-(2-hydroxy-4-oxo-5,6,7,8-tetrahydrochromen-3-yl)propyl]phenyl]benzenesulfonamide CAS Name: 4-cyano-N-[3-[1-(2-hydroxy-4-oxo-5,6,7,8-tetrahydro-1-benzopyran-3-yl)propyl]phenyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[3-[1-(2-hydroxy-4-oxo-5,6,7,8-tetrahydrochromen-3-yl)propyl]phenyl]benzenesulfonamide Traditional Name: 4-cyano-N-[3-[1-(2-hydroxy-4-keto-5,6,7,8-tetrahydrochromen-3-yl)propyl]phenyl]benzenesulfonamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C#N)C3=C(OC4=C(C3=O)CCCC4)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C#N)C3=C(OC4=C(C3=O)CCCC4)O

InChI

InChI=1S/C25H24N2O5S/c1-2-20(23-24(28)21-8-3-4-9-22(21)32-25(23)29)17-6-5-7-18(14-17)27-33(30,31)19-12-10-16(15-26)11-13-19/h5-7,10-14,20,27,29H,2-4,8-9H2,1H3