tert-butyl 2-ethanoyl-2-(3-methylbut-2-enyl)-4-(phenylsulfonyl)hexa-4,5-dienoate

Systemtic Name: tert-butyl 2-ethanoyl-2-(3-methylbut-2-enyl)-4-(phenylsulfonyl)hexa-4,5-dienoate Openeye Name: tert-butyl 2-acetyl-4-(benzenesulfonyl)-2-(3-methylbut-2-enyl)hexa-4,5-dienoate CAS Name: 2-acetyl-4-(benzenesulfonyl)-2-(3-methylbut-2-enyl)hexa-4,5-dienoic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetyl-4-(benzenesulfonyl)-2-(3-methylbut-2-enyl)hexa-4,5-dienoate Traditional Name: 2-acetyl-4-besyl-2-(3-methylbut-2-enyl)hexa-4,5-dienoic acid tert-butyl ester Formula: C23H30O5S MolecularWeight: 418.5463

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(CC(=C=C)S(=O)(=O)C1=CC=CC=C1)(C(=O)C)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC(=CCC(CC(=C=C)S(=O)(=O)C1=CC=CC=C1)(C(=O)C)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C23H30O5S/c1-8-19(29(26,27)20-12-10-9-11-13-20)16-23(18(4)24,15-14-17(2)3)21(25)28-22(5,6)7/h9-14H,1,15-16H2,2-7H3