hexyl 3-[4-tert-butyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3-methyl-butanoate

Systemtic Name: hexyl 3-[4-tert-butyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3-methyl-butanoate Openeye Name: hexyl 3-(4-tert-butyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)-3-methyl-butanoate CAS Name: 3-(4-tert-butyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)-3-methylbutanoic acid hexyl ester IUPAC Name: hexyl 3-(4-tert-butyl-3,6-dioxocyclohexa-1,4-dien-1-yl)-3-methylbutanoate Traditional Name: 3-(4-tert-butyl-3,6-diketo-cyclohexa-1,4-dien-1-yl)-3-methyl-butyric acid hexyl ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)C

Isomeric SMILES

CCCCCCOC(=O)CC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)C

InChI

InChI=1S/C21H32O4/c1-7-8-9-10-11-25-19(24)14-21(5,6)16-13-17(22)15(12-18(16)23)20(2,3)4/h12-13H,7-11,14H2,1-6H3