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

Systemtic Name: 5-[5-(4,5,7-trimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid Openeye Name: 5-[5-(4,5,7-trimethylbenzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid CAS Name: 5-[5-(4,5,7-trimethyl-2-benzofuranyl)-1H-pyrrol-2-yl]-2-furancarboxylic acid IUPAC Name: 5-[5-(4,5,7-trimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]furan-2-carboxylic acid Traditional Name: 5-[5-(4,5,7-trimethylbenzofuran-2-yl)-1H-pyrrol-2-yl]-2-furoic acid Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C)C=C(O2)C3=CC=C(N3)C4=CC=C(O4)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1C)C=C(O2)C3=CC=C(N3)C4=CC=C(O4)C(=O)O)C

InChI

InChI=1S/C20H17NO4/c1-10-8-11(2)19-13(12(10)3)9-18(25-19)15-5-4-14(21-15)16-6-7-17(24-16)20(22)23/h4-9,21H,1-3H3,(H,22,23)