2-[(3E)-3-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-6-fluoranyl-2-methyl-inden-1-yl]ethanoic acid

Systemtic Name: 2-[(3E)-3-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]-6-fluoranyl-2-methyl-inden-1-yl]ethanoic acid Openeye Name: 2-[(3E)-3-[(3-bromo-4,5-dimethoxy-phenyl)methylene]-6-fluoro-2-methyl-inden-1-yl]acetic acid CAS Name: 2-[(3E)-3-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-6-fluoro-2-methyl-1-indenyl]acetic acid IUPAC Name: 2-[(3E)-3-[(3-bromo-4,5-dimethoxyphenyl)methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Traditional Name: 2-[(3E)-3-(3-bromo-4,5-dimethoxy-benzylidene)-6-fluoro-2-methyl-inden-1-yl]acetic acid Formula: C21H18BrFO4 MolecularWeight: 433.267623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC(=C(C(=C3)Br)OC)OC)C=CC(=C2)F)CC(=O)O

Isomeric SMILES

CC\1=C(C2=C(/C1=C/C3=CC(=C(C(=C3)Br)OC)OC)C=CC(=C2)F)CC(=O)O

InChI

InChI=1S/C21H18BrFO4/c1-11-15(6-12-7-18(22)21(27-3)19(8-12)26-2)14-5-4-13(23)9-17(14)16(11)10-20(24)25/h4-9H,10H2,1-3H3,(H,24,25)/b15-6+