4-[6-(3,4,5-trimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide

Systemtic Name: 4-[6-(3,4,5-trimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide Openeye Name: 4-[6-(3,4,5-trimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide CAS Name: 4-[6-(3,4,5-trimethoxyphenyl)-5-spiro[2.4]hept-5-enyl]benzenesulfonamide IUPAC Name: 4-[6-(3,4,5-trimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide Traditional Name: 4-[6-(3,4,5-trimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(CC3(C2)CC3)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(CC3(C2)CC3)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H25NO5S/c1-26-19-10-15(11-20(27-2)21(19)28-3)18-13-22(8-9-22)12-17(18)14-4-6-16(7-5-14)29(23,24)25/h4-7,10-11H,8-9,12-13H2,1-3H3,(H2,23,24,25)