2-methoxy-3,3-dimethyl-1-[(E)-3-oxidanylideneprop-1-enyl]-2-[[2,3,5,6-tetrakis(fluoranyl)-4-prop-2-ynyl-phenyl]methyl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-methoxy-3,3-dimethyl-1-[(E)-3-oxidanylideneprop-1-enyl]-2-[[2,3,5,6-tetrakis(fluoranyl)-4-prop-2-ynyl-phenyl]methyl]cyclopropane-1-carboxylic acid Openeye Name: 2-methoxy-3,3-dimethyl-1-[(E)-3-oxoprop-1-enyl]-2-[(2,3,5,6-tetrafluoro-4-prop-2-ynyl-phenyl)methyl]cyclopropanecarboxylic acid CAS Name: 2-methoxy-3,3-dimethyl-1-[(E)-3-oxoprop-1-enyl]-2-[(2,3,5,6-tetrafluoro-4-prop-2-ynylphenyl)methyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-methoxy-3,3-dimethyl-1-[(E)-3-oxoprop-1-enyl]-2-[(2,3,5,6-tetrafluoro-4-prop-2-ynylphenyl)methyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[(E)-3-ketoprop-1-enyl]-2-methoxy-3,3-dimethyl-2-(2,3,5,6-tetrafluoro-4-propargyl-benzyl)cyclopropanecarboxylic acid Formula: C20H18F4O4 MolecularWeight: 398.348133

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C=CC=O)C(=O)O)(CC2=C(C(=C(C(=C2F)F)CC#C)F)F)OC)C

Isomeric SMILES

CC1(C(C1(/C=C/C=O)C(=O)O)(CC2=C(C(=C(C(=C2F)F)CC#C)F)F)OC)C

InChI

InChI=1S/C20H18F4O4/c1-5-7-11-13(21)15(23)12(16(24)14(11)22)10-20(28-4)18(2,3)19(20,17(26)27)8-6-9-25/h1,6,8-9H,7,10H2,2-4H3,(H,26,27)/b8-6+