4-(1-methoxycarbonyl-4-methyl-cyclohexyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(1-methoxycarbonyl-4-methyl-cyclohexyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(1-methoxycarbonyl-4-methyl-cyclohexyl)-4-oxo-butanoic acid CAS Name: 4-(1-methoxycarbonyl-4-methylcyclohexyl)-4-oxobutanoic acid IUPAC Name: 4-(1-methoxycarbonyl-4-methylcyclohexyl)-4-oxobutanoic acid Traditional Name: 4-(1-carbomethoxy-4-methyl-cyclohexyl)-4-keto-butyric acid Formula: C13H20O5 MolecularWeight: 256.2949

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)CCC(=O)O)C(=O)OC

Isomeric SMILES

CC1CCC(CC1)(C(=O)CCC(=O)O)C(=O)OC

InChI

InChI=1S/C13H20O5/c1-9-5-7-13(8-6-9,12(17)18-2)10(14)3-4-11(15)16/h9H,3-8H2,1-2H3,(H,15,16)