2-cyclohexyl-2-[[1-cyclohexyl-2-(2-phenylquinoxalin-6-yl)benzimidazol-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-cyclohexyl-2-[[1-cyclohexyl-2-(2-phenylquinoxalin-6-yl)benzimidazol-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-cyclohexyl-2-[[1-cyclohexyl-2-(2-phenylquinoxalin-6-yl)benzimidazole-5-carbonyl]amino]acetic acid CAS Name: 2-cyclohexyl-2-[[[1-cyclohexyl-2-(2-phenyl-6-quinoxalinyl)-5-benzimidazolyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-cyclohexyl-2-[[1-cyclohexyl-2-(2-phenylquinoxalin-6-yl)benzimidazole-5-carbonyl]amino]acetic acid Traditional Name: 2-cyclohexyl-2-[[1-cyclohexyl-2-(2-phenylquinoxalin-6-yl)benzimidazole-5-carbonyl]amino]acetic acid Formula: C36H37N5O3 MolecularWeight: 587.71068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC5=NC=C(N=C5C=C4)C6=CC=CC=C6)C7CCCCC7

Isomeric SMILES

C1CCC(CC1)C(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC5=NC=C(N=C5C=C4)C6=CC=CC=C6)C7CCCCC7

InChI

InChI=1S/C36H37N5O3/c42-35(40-33(36(43)44)24-12-6-2-7-13-24)26-17-19-32-30(21-26)39-34(41(32)27-14-8-3-9-15-27)25-16-18-28-29(20-25)37-22-31(38-28)23-10-4-1-5-11-23/h1,4-5,10-11,16-22,24,27,33H,2-3,6-9,12-15H2,(H,40,42)(H,43,44)