6-[2-(3-methoxypyrrolidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-2-methyl-1-benzofuran-3-carboxylic acid

Systemtic Name: 6-[2-(3-methoxypyrrolidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-2-methyl-1-benzofuran-3-carboxylic acid Openeye Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-benzofuran-3-carboxylic acid CAS Name: 6-[[2-[(3-methoxy-1-pyrrolidinyl)-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]-2-methyl-3-benzofurancarboxylic acid IUPAC Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-1-benzofuran-3-carboxylic acid Traditional Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-benzofuran-3-carboxylic acid Formula: C23H20N2O6S MolecularWeight: 452.4797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)OC)C(=O)O

Isomeric SMILES

CC1=C(C2=C(O1)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)OC)C(=O)O

InChI

InChI=1S/C23H20N2O6S/c1-12-20(23(27)28)15-4-3-13(9-18(15)30-12)31-17-5-7-24-16-10-19(32-21(16)17)22(26)25-8-6-14(11-25)29-2/h3-5,7,9-10,14H,6,8,11H2,1-2H3,(H,27,28)