2-[2,3-bis(3-methoxyphenyl)quinoxalin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[2,3-bis(3-methoxyphenyl)quinoxalin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[2,3-bis(3-methoxyphenyl)quinoxalin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[2,3-bis(3-methoxyphenyl)-6-quinoxalinyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[2,3-bis(3-methoxyphenyl)quinoxalin-6-yl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[2,3-bis(3-methoxyphenyl)quinoxalin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C36H32N4O4 MolecularWeight: 584.66368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)N=C2C7=CC(=CC=C7)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)N=C2C7=CC(=CC=C7)OC

InChI

InChI=1S/C36H32N4O4/c1-43-27-12-6-8-22(18-27)33-34(23-9-7-13-28(19-23)44-2)38-30-20-24(14-16-29(30)37-33)35-39-31-21-25(36(41)42)15-17-32(31)40(35)26-10-4-3-5-11-26/h6-9,12-21,26H,3-5,10-11H2,1-2H3,(H,41,42)