2-[4-(1-benzofuran-2-ylmethyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]ethanoic acid

Systemtic Name: 2-[4-(1-benzofuran-2-ylmethyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]ethanoic acid Openeye Name: 2-[4-(benzofuran-2-ylmethyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid CAS Name: 2-[4-(2-benzofuranylmethyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid IUPAC Name: 2-[4-(1-benzofuran-2-ylmethyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid Traditional Name: 2-[4-(benzofuran-2-ylmethyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]acetic acid Formula: C19H16N2O3 MolecularWeight: 320.34194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CN=C2N1)CC3=CC4=CC=CC=C4O3)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(C=CN=C2N1)CC3=CC4=CC=CC=C4O3)CC(=O)O

InChI

InChI=1S/C19H16N2O3/c1-11-15(10-17(22)23)18-13(6-7-20-19(18)21-11)9-14-8-12-4-2-3-5-16(12)24-14/h2-8H,9-10H2,1H3,(H,20,21)(H,22,23)