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

Systemtic Name: 4-[6-(4-fluoranyl-3-methyl-phenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Openeye Name: 4-[6-(4-fluoro-3-methyl-phenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide CAS Name: 4-[6-(4-fluoro-3-methylphenyl)-5-spiro[2.4]hepta-4,6-dienyl]benzenesulfonamide IUPAC Name: 4-[6-(4-fluoro-3-methylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Traditional Name: 4-[6-(4-fluoro-3-methyl-phenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Formula: C20H18FNO2S MolecularWeight: 355.425823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18FNO2S/c1-13-10-15(4-7-19(13)21)18-12-20(8-9-20)11-17(18)14-2-5-16(6-3-14)25(22,23)24/h2-7,10-12H,8-9H2,1H3,(H2,22,23,24)