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

Systemtic Name: hexyl 5-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoate Openeye Name: hexyl 5-(3,6-dioxocyclohexa-1,4-dien-1-yl)-5-methyl-hexanoate CAS Name: 5-(3,6-dioxo-1-cyclohexa-1,4-dienyl)-5-methylhexanoic acid hexyl ester IUPAC Name: hexyl 5-(3,6-dioxocyclohexa-1,4-dien-1-yl)-5-methylhexanoate Traditional Name: 5-(3,6-diketocyclohexa-1,4-dien-1-yl)-5-methyl-hexanoic acid hexyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28O4/c1-4-5-6-7-13-23-18(22)9-8-12-19(2,3)16-14-15(20)10-11-17(16)21/h10-11,14H,4-9,12-13H2,1-3H3