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

Systemtic Name: 4-[6-(3,4-dimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide Openeye Name: 4-[6-(3,4-dimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide CAS Name: 4-[6-(3,4-dimethoxyphenyl)-5-spiro[2.4]hept-5-enyl]benzenesulfonamide IUPAC Name: 4-[6-(3,4-dimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide Traditional Name: 4-[6-(3,4-dimethoxyphenyl)spiro[2.4]hept-5-en-5-yl]benzenesulfonamide Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(CC3(C2)CC3)C4=CC=C(C=C4)S(=O)(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(CC3(C2)CC3)C4=CC=C(C=C4)S(=O)(=O)N)OC

InChI

InChI=1S/C21H23NO4S/c1-25-19-8-5-15(11-20(19)26-2)18-13-21(9-10-21)12-17(18)14-3-6-16(7-4-14)27(22,23)24/h3-8,11H,9-10,12-13H2,1-2H3,(H2,22,23,24)