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

Systemtic Name: methyl 5-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O4/c1-14(2,8-4-5-13(17)18-3)11-9-10(15)6-7-12(11)16/h6-7,9H,4-5,8H2,1-3H3