methyl 5-(6-methyl-6-oxidanyl-cyclohexa-2,4-dien-1-yl)-3,5-bis(oxidanylidene)pentanoate

Systemtic Name: methyl 5-(6-methyl-6-oxidanyl-cyclohexa-2,4-dien-1-yl)-3,5-bis(oxidanylidene)pentanoate Openeye Name: methyl 5-(6-hydroxy-6-methyl-cyclohexa-2,4-dien-1-yl)-3,5-dioxo-pentanoate CAS Name: 5-(6-hydroxy-6-methyl-1-cyclohexa-2,4-dienyl)-3,5-dioxopentanoic acid methyl ester IUPAC Name: methyl 5-(6-hydroxy-6-methylcyclohexa-2,4-dien-1-yl)-3,5-dioxopentanoate Traditional Name: 5-(6-hydroxy-6-methyl-cyclohexa-2,4-dien-1-yl)-3,5-diketo-valeric acid methyl ester Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC=CC1C(=O)CC(=O)CC(=O)OC)O

Isomeric SMILES

CC1(C=CC=CC1C(=O)CC(=O)CC(=O)OC)O

InChI

InChI=1S/C13H16O5/c1-13(17)6-4-3-5-10(13)11(15)7-9(14)8-12(16)18-2/h3-6,10,17H,7-8H2,1-2H3