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

Systemtic Name: 2-[2-(2-bromophenyl)-3-phenyl-quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[2-(2-bromophenyl)-3-phenyl-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[2-(2-bromophenyl)-3-phenyl-6-quinolinyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[2-(2-bromophenyl)-3-phenylquinolin-6-yl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[2-(2-bromophenyl)-3-phenyl-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C35H28BrN3O2 MolecularWeight: 602.51972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=CC(=C(N=C5C=C4)C6=CC=CC=C6Br)C7=CC=CC=C7

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=CC(=C(N=C5C=C4)C6=CC=CC=C6Br)C7=CC=CC=C7

InChI

InChI=1S/C35H28BrN3O2/c36-29-14-8-7-13-27(29)33-28(22-9-3-1-4-10-22)20-25-19-23(15-17-30(25)37-33)34-38-31-21-24(35(40)41)16-18-32(31)39(34)26-11-5-2-6-12-26/h1,3-4,7-10,13-21,26H,2,5-6,11-12H2,(H,40,41)