N-[3-[cyclopropyl-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]phenyl]propane-1-sulfonamide

Systemtic Name: N-[3-[cyclopropyl-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]phenyl]propane-1-sulfonamide Openeye Name: N-[3-[[6-(1-benzylpropyl)-2-hydroxy-4-oxo-pyran-3-yl]-cyclopropyl-methyl]phenyl]propane-1-sulfonamide CAS Name: N-[3-[cyclopropyl-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)-3-pyranyl]methyl]phenyl]-1-propanesulfonamide IUPAC Name: N-[3-[cyclopropyl-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]phenyl]propane-1-sulfonamide Traditional Name: N-[3-[[6-(1-benzylpropyl)-2-hydroxy-4-keto-pyran-3-yl]-cyclopropyl-methyl]phenyl]propane-1-sulfonamide Formula: C28H33NO5S MolecularWeight: 495.63032

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC=CC(=C1)C(C2CC2)C3=C(OC(=CC3=O)C(CC)CC4=CC=CC=C4)O

Isomeric SMILES

CCCS(=O)(=O)NC1=CC=CC(=C1)C(C2CC2)C3=C(OC(=CC3=O)C(CC)CC4=CC=CC=C4)O

InChI

InChI=1S/C28H33NO5S/c1-3-15-35(32,33)29-23-12-8-11-22(17-23)26(21-13-14-21)27-24(30)18-25(34-28(27)31)20(4-2)16-19-9-6-5-7-10-19/h5-12,17-18,20-21,26,29,31H,3-4,13-16H2,1-2H3