hexyl 5-methyl-5-[5-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]hexanoate

Systemtic Name: hexyl 5-methyl-5-[5-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]hexanoate Openeye Name: hexyl 5-methyl-5-(5-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)hexanoate CAS Name: 5-methyl-5-(5-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)hexanoic acid hexyl ester IUPAC Name: hexyl 5-methyl-5-(5-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)hexanoate Traditional Name: 5-(3,6-diketo-5-methyl-cyclohexa-1,4-dien-1-yl)-5-methyl-hexanoic acid hexyl ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30O4/c1-5-6-7-8-12-24-18(22)10-9-11-20(3,4)17-14-16(21)13-15(2)19(17)23/h13-14H,5-12H2,1-4H3