1-cyclohexyl-2-[2-(5-methoxy-1-benzofuran-3-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[2-(5-methoxy-1-benzofuran-3-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-(5-methoxybenzofuran-3-yl)-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-(5-methoxy-3-benzofuranyl)-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-(5-methoxy-1-benzofuran-3-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[2-(5-methoxybenzofuran-3-yl)-6-quinolyl]benzimidazole-5-carboxylic acid Formula: C32H27N3O4 MolecularWeight: 517.57448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC=C2C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CCCCC7)C=CC(=C6)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)OC=C2C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CCCCC7)C=CC(=C6)C(=O)O

InChI

InChI=1S/C32H27N3O4/c1-38-23-10-14-30-24(17-23)25(18-39-30)27-12-7-19-15-20(8-11-26(19)33-27)31-34-28-16-21(32(36)37)9-13-29(28)35(31)22-5-3-2-4-6-22/h7-18,22H,2-6H2,1H3,(H,36,37)