4-chloranyl-3-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 4-chloranyl-3-methyl-cyclohexane-1-carboxylic acid Openeye Name: 4-chloro-3-methyl-cyclohexanecarboxylic acid CAS Name: 4-chloro-3-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 4-chloro-3-methylcyclohexane-1-carboxylic acid Traditional Name: 4-chloro-3-methyl-cyclohexanecarboxylic acid Formula: C8H13ClO2 MolecularWeight: 176.64062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCC1Cl)C(=O)O

Isomeric SMILES

CC1CC(CCC1Cl)C(=O)O

InChI

InChI=1S/C8H13ClO2/c1-5-4-6(8(10)11)2-3-7(5)9/h5-7H,2-4H2,1H3,(H,10,11)