ethyl 3-[3-bromanyl-4-cyclohexyl-5-(trifluoromethyl)phenyl]-2-chloranyl-propanoate

Systemtic Name: ethyl 3-[3-bromanyl-4-cyclohexyl-5-(trifluoromethyl)phenyl]-2-chloranyl-propanoate Openeye Name: ethyl 3-[3-bromo-4-cyclohexyl-5-(trifluoromethyl)phenyl]-2-chloro-propanoate CAS Name: 3-[3-bromo-4-cyclohexyl-5-(trifluoromethyl)phenyl]-2-chloropropanoic acid ethyl ester IUPAC Name: ethyl 3-[3-bromo-4-cyclohexyl-5-(trifluoromethyl)phenyl]-2-chloropropanoate Traditional Name: 3-[3-bromo-4-cyclohexyl-5-(trifluoromethyl)phenyl]-2-chloro-propionic acid ethyl ester Formula: C18H21BrClF3O2 MolecularWeight: 441.71035

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C(=C1)Br)C2CCCCC2)C(F)(F)F)Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C(=C1)Br)C2CCCCC2)C(F)(F)F)Cl

InChI

InChI=1S/C18H21BrClF3O2/c1-2-25-17(24)15(20)10-11-8-13(18(21,22)23)16(14(19)9-11)12-6-4-3-5-7-12/h8-9,12,15H,2-7,10H2,1H3