2-[2-[5-(4-chlorophenyl)-2-methyl-furan-3-yl]quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[2-[5-(4-chlorophenyl)-2-methyl-furan-3-yl]quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[2-[5-(4-chlorophenyl)-2-methyl-3-furyl]-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[2-[5-(4-chlorophenyl)-2-methyl-3-furanyl]-6-quinolinyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[2-[5-(4-chlorophenyl)-2-methylfuran-3-yl]quinolin-6-yl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[2-[5-(4-chlorophenyl)-2-methyl-3-furyl]-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C34H28ClN3O3 MolecularWeight: 562.05742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC=C(C=C2)Cl)C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CCCCC7)C=CC(=C6)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C2=CC=C(C=C2)Cl)C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CCCCC7)C=CC(=C6)C(=O)O

InChI

InChI=1S/C34H28ClN3O3/c1-20-27(19-32(41-20)21-7-12-25(35)13-8-21)29-15-9-22-17-23(10-14-28(22)36-29)33-37-30-18-24(34(39)40)11-16-31(30)38(33)26-5-3-2-4-6-26/h7-19,26H,2-6H2,1H3,(H,39,40)