1-butyl-2-methyl-3,6-bis(oxidanylidene)cyclohexane-1,2-dicarboxylic acid

Systemtic Name: 1-butyl-2-methyl-3,6-bis(oxidanylidene)cyclohexane-1,2-dicarboxylic acid Openeye Name: 1-butyl-2-methyl-3,6-dioxo-cyclohexane-1,2-dicarboxylic acid CAS Name: 1-butyl-2-methyl-3,6-dioxocyclohexane-1,2-dicarboxylic acid IUPAC Name: 1-butyl-2-methyl-3,6-dioxocyclohexane-1,2-dicarboxylic acid Traditional Name: 1-butyl-3,6-diketo-2-methyl-cyclohexane-1,2-dicarboxylic acid Formula: C13H18O6 MolecularWeight: 270.27842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)CCC(=O)C1(C)C(=O)O)C(=O)O

Isomeric SMILES

CCCCC1(C(=O)CCC(=O)C1(C)C(=O)O)C(=O)O

InChI

InChI=1S/C13H18O6/c1-3-4-7-13(11(18)19)9(15)6-5-8(14)12(13,2)10(16)17/h3-7H2,1-2H3,(H,16,17)(H,18,19)