methyl 3-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoate

Systemtic Name: methyl 3-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoate Openeye Name: methyl 3-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)propanoate CAS Name: 3-(2,4,5-trimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoate Traditional Name: 3-(3,6-diketo-2,4,5-trimethyl-cyclohexa-1,4-dien-1-yl)propionic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)CCC(=O)OC)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)CCC(=O)OC)C

InChI

InChI=1S/C13H16O4/c1-7-8(2)13(16)10(9(3)12(7)15)5-6-11(14)17-4/h5-6H2,1-4H3