2-acetamido-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-acetamido-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 2-acetamido-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid CAS Name: 2-acetamido-1-cyclohexyl-6-phenethyloxy-4-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-acetamido-1-cyclohexyl-6-phenethyloxy-4-phenylbenzimidazole-5-carboxylic acid Traditional Name: 2-acetamido-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=C(C=C2N1C3CCCCC3)OCCC4=CC=CC=C4)C(=O)O)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=C(C=C2N1C3CCCCC3)OCCC4=CC=CC=C4)C(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C30H31N3O4/c1-20(34)31-30-32-28-24(33(30)23-15-9-4-10-16-23)19-25(37-18-17-21-11-5-2-6-12-21)27(29(35)36)26(28)22-13-7-3-8-14-22/h2-3,5-8,11-14,19,23H,4,9-10,15-18H2,1H3,(H,35,36)(H,31,32,34)