5-(2-chloranylethanoyl)-2-oxidanyl-cyclohexane-1-carboxylic acid

Systemtic Name: 5-(2-chloranylethanoyl)-2-oxidanyl-cyclohexane-1-carboxylic acid Openeye Name: 5-(2-chloroacetyl)-2-hydroxy-cyclohexanecarboxylic acid CAS Name: 5-(2-chloro-1-oxoethyl)-2-hydroxy-1-cyclohexanecarboxylic acid IUPAC Name: 5-(2-chloroacetyl)-2-hydroxycyclohexane-1-carboxylic acid Traditional Name: 5-(2-chloroacetyl)-2-hydroxy-cyclohexanecarboxylic acid Formula: C9H13ClO4 MolecularWeight: 220.65012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1C(=O)CCl)C(=O)O)O

Isomeric SMILES

C1CC(C(CC1C(=O)CCl)C(=O)O)O

InChI

InChI=1S/C9H13ClO4/c10-4-8(12)5-1-2-7(11)6(3-5)9(13)14/h5-7,11H,1-4H2,(H,13,14)