2-[1-methyl-2,6-bis(oxidanylidene)cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-methyl-2,6-bis(oxidanylidene)cyclohexyl]ethanoic acid Openeye Name: 2-(1-methyl-2,6-dioxo-cyclohexyl)acetic acid CAS Name: 2-(1-methyl-2,6-dioxocyclohexyl)acetic acid IUPAC Name: 2-(1-methyl-2,6-dioxocyclohexyl)acetic acid Traditional Name: 2-(2,6-diketo-1-methyl-cyclohexyl)acetic acid Formula: C9H12O4 MolecularWeight: 184.18918

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)CCCC1=O)CC(=O)O

Isomeric SMILES

CC1(C(=O)CCCC1=O)CC(=O)O

InChI

InChI=1S/C9H12O4/c1-9(5-8(12)13)6(10)3-2-4-7(9)11/h2-5H2,1H3,(H,12,13)