5-cyano-2-[2-(4-methoxyphenyl)ethyl]-1-benzofuran-3-carboxylic acid

Systemtic Name: 5-cyano-2-[2-(4-methoxyphenyl)ethyl]-1-benzofuran-3-carboxylic acid Openeye Name: 5-cyano-2-[2-(4-methoxyphenyl)ethyl]benzofuran-3-carboxylic acid CAS Name: 5-cyano-2-[2-(4-methoxyphenyl)ethyl]-3-benzofurancarboxylic acid IUPAC Name: 5-cyano-2-[2-(4-methoxyphenyl)ethyl]-1-benzofuran-3-carboxylic acid Traditional Name: 5-cyano-2-[2-(4-methoxyphenyl)ethyl]benzofuran-3-carboxylic acid Formula: C19H15NO4 MolecularWeight: 321.3267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2=C(C3=C(O2)C=CC(=C3)C#N)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCC2=C(C3=C(O2)C=CC(=C3)C#N)C(=O)O

InChI

InChI=1S/C19H15NO4/c1-23-14-6-2-12(3-7-14)4-9-17-18(19(21)22)15-10-13(11-20)5-8-16(15)24-17/h2-3,5-8,10H,4,9H2,1H3,(H,21,22)