3-[1,4-dimethyl-2,5-bis(oxidanylidene)cyclohex-3-en-1-yl]-3-methyl-butanoate

Systemtic Name: 3-[1,4-dimethyl-2,5-bis(oxidanylidene)cyclohex-3-en-1-yl]-3-methyl-butanoate Openeye Name: 3-(1,4-dimethyl-2,5-dioxo-cyclohex-3-en-1-yl)-3-methyl-butanoate CAS Name: 3-(1,4-dimethyl-2,5-dioxo-1-cyclohex-3-enyl)-3-methylbutanoate IUPAC Name: 3-(1,4-dimethyl-2,5-dioxocyclohex-3-en-1-yl)-3-methylbutanoate Traditional Name: 3-(2,5-diketo-1,4-dimethyl-cyclohex-3-en-1-yl)-3-methyl-butyrate Formula: C13H17O4- MolecularWeight: 237.27168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(CC1=O)(C)C(C)(C)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(CC1=O)(C)C(C)(C)CC(=O)[O-]

InChI

InChI=1S/C13H18O4/c1-8-5-10(15)13(4,6-9(8)14)12(2,3)7-11(16)17/h5H,6-7H2,1-4H3,(H,16,17)/p-1