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

Systemtic Name: 2-azanyl-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 2-amino-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid CAS Name: 2-amino-1-cyclohexyl-6-phenethyloxy-4-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-amino-1-cyclohexyl-6-phenethyloxy-4-phenylbenzimidazole-5-carboxylic acid Traditional Name: 2-amino-1-cyclohexyl-6-phenethyloxy-4-phenyl-benzimidazole-5-carboxylic acid Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=CC(=C(C(=C3N=C2N)C4=CC=CC=C4)C(=O)O)OCCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C3=CC(=C(C(=C3N=C2N)C4=CC=CC=C4)C(=O)O)OCCC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c29-28-30-26-22(31(28)21-14-8-3-9-15-21)18-23(34-17-16-19-10-4-1-5-11-19)25(27(32)33)24(26)20-12-6-2-7-13-20/h1-2,4-7,10-13,18,21H,3,8-9,14-17H2,(H2,29,30)(H,32,33)