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

Systemtic Name: 4-[6-(4-methoxy-3-methyl-phenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Openeye Name: 4-[6-(4-methoxy-3-methyl-phenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide CAS Name: 4-[6-(4-methoxy-3-methylphenyl)-5-spiro[2.4]hepta-4,6-dienyl]benzenesulfonamide IUPAC Name: 4-[6-(4-methoxy-3-methylphenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Traditional Name: 4-[6-(4-methoxy-3-methyl-phenyl)spiro[2.4]hepta-4,6-dien-5-yl]benzenesulfonamide Formula: C21H21NO3S MolecularWeight: 367.46134

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO3S/c1-14-11-16(5-8-20(14)25-2)19-13-21(9-10-21)12-18(19)15-3-6-17(7-4-15)26(22,23)24/h3-8,11-13H,9-10H2,1-2H3,(H2,22,23,24)