4-[6-(3,4-dimethylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide

Systemtic Name: 4-[6-(3,4-dimethylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Openeye Name: 4-[6-(3,4-dimethylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide CAS Name: 4-[6-(3,4-dimethylphenyl)-5-spiro[2.4]hepta-4,6-dienyl]benzenesulfonamide IUPAC Name: 4-[6-(3,4-dimethylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Traditional Name: 4-[6-(3,4-dimethylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Formula: C21H21NO2S MolecularWeight: 351.46194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC3(CC3)C=C2C4=CC=C(C=C4)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC3(CC3)C=C2C4=CC=C(C=C4)S(=O)(=O)N)C

InChI

InChI=1S/C21H21NO2S/c1-14-3-4-17(11-15(14)2)20-13-21(9-10-21)12-19(20)16-5-7-18(8-6-16)25(22,23)24/h3-8,11-13H,9-10H2,1-2H3,(H2,22,23,24)