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

Systemtic Name: 5-[5-(7-ethyl-4-methoxy-1-benzofuran-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxylic acid Openeye Name: 5-[5-(7-ethyl-4-methoxy-benzofuran-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxylic acid CAS Name: 5-[5-(7-ethyl-4-methoxy-2-benzofuranyl)-1H-pyrrol-2-yl]-2-thiophenecarboxylic acid IUPAC Name: 5-[5-(7-ethyl-4-methoxy-1-benzofuran-2-yl)-1H-pyrrol-2-yl]thiophene-2-carboxylic acid Traditional Name: 5-[5-(7-ethyl-4-methoxy-benzofuran-2-yl)-1H-pyrrol-2-yl]-2-thenoic acid Formula: C20H17NO4S MolecularWeight: 367.41828

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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(S4)C(=O)O

Isomeric SMILES

CCC1=C2C(=C(C=C1)OC)C=C(O2)C3=CC=C(N3)C4=CC=C(S4)C(=O)O

InChI

InChI=1S/C20H17NO4S/c1-3-11-4-7-15(24-2)12-10-16(25-19(11)12)13-5-6-14(21-13)17-8-9-18(26-17)20(22)23/h4-10,21H,3H2,1-2H3,(H,22,23)