4-cyano-N-[3-[cyclopropyl-(7-methoxy-2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[3-[cyclopropyl-(7-methoxy-2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]phenyl]benzenesulfonamide Openeye Name: 4-cyano-N-[3-[cyclopropyl-(2-hydroxy-7-methoxy-4-oxo-chromen-3-yl)methyl]phenyl]benzenesulfonamide CAS Name: 4-cyano-N-[3-[cyclopropyl-(2-hydroxy-7-methoxy-4-oxo-1-benzopyran-3-yl)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[3-[cyclopropyl-(2-hydroxy-7-methoxy-4-oxochromen-3-yl)methyl]phenyl]benzenesulfonamide Traditional Name: 4-cyano-N-[3-[cyclopropyl-(2-hydroxy-4-keto-7-methoxy-chromen-3-yl)methyl]phenyl]benzenesulfonamide Formula: C27H22N2O6S MolecularWeight: 502.53838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H22N2O6S/c1-34-20-9-12-22-23(14-20)35-27(31)25(26(22)30)24(17-7-8-17)18-3-2-4-19(13-18)29-36(32,33)21-10-5-16(15-28)6-11-21/h2-6,9-14,17,24,29,31H,7-8H2,1H3