4-[[1-[2-cyano-2-(2-fluorophenyl)ethenyl]naphthalen-2-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[1-[2-cyano-2-(2-fluorophenyl)ethenyl]naphthalen-2-yl]oxymethyl]benzoic acid Openeye Name: 4-[[1-[2-cyano-2-(2-fluorophenyl)vinyl]-2-naphthyl]oxymethyl]benzoic acid CAS Name: 4-[[1-[2-cyano-2-(2-fluorophenyl)ethenyl]-2-naphthalenyl]oxymethyl]benzoic acid IUPAC Name: 4-[[1-[2-cyano-2-(2-fluorophenyl)ethenyl]naphthalen-2-yl]oxymethyl]benzoic acid Traditional Name: 4-[[1-[2-cyano-2-(2-fluorophenyl)vinyl]-2-naphthoxy]methyl]benzoic acid Formula: C27H18FNO3 MolecularWeight: 423.435123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)C3=CC=CC=C3F)OCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)C3=CC=CC=C3F)OCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C27H18FNO3/c28-25-8-4-3-7-23(25)21(16-29)15-24-22-6-2-1-5-19(22)13-14-26(24)32-17-18-9-11-20(12-10-18)27(30)31/h1-15H,17H2,(H,30,31)