1-adamantylmethyl 2,2-bis(chloranyl)ethanoate

Systemtic Name: 1-adamantylmethyl 2,2-bis(chloranyl)ethanoate Openeye Name: 1-adamantylmethyl 2,2-dichloroacetate CAS Name: 2,2-dichloroacetic acid 1-adamantylmethyl ester IUPAC Name: 1-adamantylmethyl 2,2-dichloroacetate Traditional Name: 2,2-dichloroacetic acid 1-adamantylmethyl ester Formula: C13H18Cl2O2 MolecularWeight: 277.18682

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)COC(=O)C(Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)COC(=O)C(Cl)Cl

InChI

InChI=1S/C13H18Cl2O2/c14-11(15)12(16)17-7-13-4-8-1-9(5-13)3-10(2-8)6-13/h8-11H,1-7H2