4-[2-(5-cyano-1-benzofuran-2-yl)ethyl]benzoic acid

Systemtic Name: 4-[2-(5-cyano-1-benzofuran-2-yl)ethyl]benzoic acid Openeye Name: 4-[2-(5-cyanobenzofuran-2-yl)ethyl]benzoic acid CAS Name: 4-[2-(5-cyano-2-benzofuranyl)ethyl]benzoic acid IUPAC Name: 4-[2-(5-cyano-1-benzofuran-2-yl)ethyl]benzoic acid Traditional Name: 4-[2-(5-cyanobenzofuran-2-yl)ethyl]benzoic acid Formula: C18H13NO3 MolecularWeight: 291.30072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CC3=C(O2)C=CC(=C3)C#N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC2=CC3=C(O2)C=CC(=C3)C#N)C(=O)O

InChI

InChI=1S/C18H13NO3/c19-11-13-4-8-17-15(9-13)10-16(22-17)7-3-12-1-5-14(6-2-12)18(20)21/h1-2,4-6,8-10H,3,7H2,(H,20,21)