propan-2-yl 2-oxidanylidene-4-[4-(trifluoromethyl)phenyl]but-3-ynoate

Systemtic Name: propan-2-yl 2-oxidanylidene-4-[4-(trifluoromethyl)phenyl]but-3-ynoate Openeye Name: isopropyl 2-oxo-4-[4-(trifluoromethyl)phenyl]but-3-ynoate CAS Name: 2-oxo-4-[4-(trifluoromethyl)phenyl]-3-butynoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-oxo-4-[4-(trifluoromethyl)phenyl]but-3-ynoate Traditional Name: 2-keto-4-[4-(trifluoromethyl)phenyl]but-3-ynoic acid isopropyl ester Formula: C14H11F3O3 MolecularWeight: 284.23055

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=O)C#CC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)OC(=O)C(=O)C#CC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C14H11F3O3/c1-9(2)20-13(19)12(18)8-5-10-3-6-11(7-4-10)14(15,16)17/h3-4,6-7,9H,1-2H3