4,4-bis(chloranyl)-2-ethyl-cyclohexa-2,5-diene-1-carboxylic acid

Systemtic Name: 4,4-bis(chloranyl)-2-ethyl-cyclohexa-2,5-diene-1-carboxylic acid Openeye Name: 4,4-dichloro-2-ethyl-cyclohexa-2,5-diene-1-carboxylic acid CAS Name: 4,4-dichloro-2-ethyl-1-cyclohexa-2,5-dienecarboxylic acid IUPAC Name: 4,4-dichloro-2-ethylcyclohexa-2,5-diene-1-carboxylic acid Traditional Name: 4,4-dichloro-2-ethyl-cyclohexa-2,5-diene-1-carboxylic acid Formula: C9H10Cl2O2 MolecularWeight: 221.0805

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(C=CC1C(=O)O)(Cl)Cl

Isomeric SMILES

CCC1=CC(C=CC1C(=O)O)(Cl)Cl

InChI

InChI=1S/C9H10Cl2O2/c1-2-6-5-9(10,11)4-3-7(6)8(12)13/h3-5,7H,2H2,1H3,(H,12,13)