2-[3-(4-cyanophenyl)-2-methyl-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-cyanophenyl)-2-methyl-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[3-(4-cyanophenyl)-2-methyl-benzofuran-5-yl]acetic acid CAS Name: 2-[3-(4-cyanophenyl)-2-methyl-5-benzofuranyl]acetic acid IUPAC Name: 2-[3-(4-cyanophenyl)-2-methyl-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[3-(4-cyanophenyl)-2-methyl-benzofuran-5-yl]acetic acid Formula: C18H13NO3 MolecularWeight: 291.30072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)CC(=O)O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)CC(=O)O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H13NO3/c1-11-18(14-5-2-12(10-19)3-6-14)15-8-13(9-17(20)21)4-7-16(15)22-11/h2-8H,9H2,1H3,(H,20,21)