3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl 2-chloranylethanoate

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl 2-chloranylethanoate Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl 2-chloroacetate CAS Name: 2-chloroacetic acid 3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl ester IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl 2-chloroacetate Traditional Name: 2-chloroacetic acid 3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl ester Formula: C13H7ClF6O2 MolecularWeight: 344.636899

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C#CCOC(=O)CCl

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C#CCOC(=O)CCl

InChI

InChI=1S/C13H7ClF6O2/c14-7-11(21)22-3-1-2-8-4-9(12(15,16)17)6-10(5-8)13(18,19)20/h4-6H,3,7H2