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

Systemtic Name: 1-cyclohexyl-2-[2-(2,3-dihydro-1-benzofuran-5-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-(2,3-dihydrobenzofuran-5-yl)-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-(2,3-dihydrobenzofuran-5-yl)-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-(2,3-dihydro-1-benzofuran-5-yl)quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 2-(2-coumaran-5-yl-6-quinolyl)-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C31H27N3O3 MolecularWeight: 489.56438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CC7=C(C=C6)OCC7

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CC7=C(C=C6)OCC7

InChI

InChI=1S/C31H27N3O3/c35-31(36)23-8-12-28-27(18-23)33-30(34(28)24-4-2-1-3-5-24)22-7-11-26-19(17-22)6-10-25(32-26)20-9-13-29-21(16-20)14-15-37-29/h6-13,16-18,24H,1-5,14-15H2,(H,35,36)