4-[2-[2-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-[2-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[2-[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]-1-cyano-vinyl]benzoic acid CAS Name: 4-[2-[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]-1-cyanoethenyl]benzoic acid Traditional Name: 4-[2-[2-bromo-4-(4-fluorobenzyl)oxy-5-methoxy-phenyl]-1-cyano-vinyl]benzoic acid Formula: C24H17BrFNO4 MolecularWeight: 482.298483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C24H17BrFNO4/c1-30-22-11-18(10-19(13-27)16-4-6-17(7-5-16)24(28)29)21(25)12-23(22)31-14-15-2-8-20(26)9-3-15/h2-12H,14H2,1H3,(H,28,29)