5-[5-(7-ethyl-4-methoxy-1-benzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid

Systemtic Name: 5-[5-(7-ethyl-4-methoxy-1-benzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid Openeye Name: 5-[5-(7-ethyl-4-methoxy-benzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid CAS Name: 5-[5-(7-ethyl-4-methoxy-2-benzofuranyl)-1H-pyrrol-2-yl]-2-furancarboxylic acid IUPAC Name: 5-[5-(7-ethyl-4-methoxy-1-benzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid Traditional Name: 5-[5-(7-ethyl-4-methoxy-benzofuran-2-yl)-1H-pyrrol-2-yl]-2-furoic acid Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=C(C=C1)OC)C=C(O2)C3=CC=C(N3)C4=CC=C(O4)C(=O)O

Isomeric SMILES

CCC1=C2C(=C(C=C1)OC)C=C(O2)C3=CC=C(N3)C4=CC=C(O4)C(=O)O

InChI

InChI=1S/C20H17NO5/c1-3-11-4-7-15(24-2)12-10-18(26-19(11)12)14-6-5-13(21-14)16-8-9-17(25-16)20(22)23/h4-10,21H,3H2,1-2H3,(H,22,23)