1-(4-oxidanyl-4-oxidanylidene-butyl)cycloheptane-1-carboxylic acid

Systemtic Name: 1-(4-oxidanyl-4-oxidanylidene-butyl)cycloheptane-1-carboxylic acid Openeye Name: 1-(4-hydroxy-4-oxo-butyl)cycloheptanecarboxylic acid CAS Name: 1-(4-hydroxy-4-oxobutyl)-1-cycloheptanecarboxylic acid IUPAC Name: 1-(4-hydroxy-4-oxobutyl)cycloheptane-1-carboxylic acid Traditional Name: 1-(4-hydroxy-4-keto-butyl)cycloheptanecarboxylic acid Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CCCC(=O)O)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CCCC(=O)O)C(=O)O

InChI

InChI=1S/C12H20O4/c13-10(14)6-5-9-12(11(15)16)7-3-1-2-4-8-12/h1-9H2,(H,13,14)(H,15,16)