5-[[4-aminocarbonyl-5-(1-oxidanylbutyl)-2-propyl-imidazol-1-yl]methyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[[4-aminocarbonyl-5-(1-oxidanylbutyl)-2-propyl-imidazol-1-yl]methyl]-2-phenyl-benzoic acid Openeye Name: 5-[[4-carbamoyl-5-(1-hydroxybutyl)-2-propyl-imidazol-1-yl]methyl]-2-phenyl-benzoic acid CAS Name: 5-[[4-carbamoyl-5-(1-hydroxybutyl)-2-propyl-1-imidazolyl]methyl]-2-phenylbenzoic acid IUPAC Name: 5-[[4-carbamoyl-5-(1-hydroxybutyl)-2-propylimidazol-1-yl]methyl]-2-phenylbenzoic acid Traditional Name: 5-[[4-carbamoyl-5-(1-hydroxybutyl)-2-propyl-imidazol-1-yl]methyl]-2-phenyl-benzoic acid Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)C(CCC)O)C(=O)N

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)C(CCC)O)C(=O)N

InChI

InChI=1S/C25H29N3O4/c1-3-8-20(29)23-22(24(26)30)27-21(9-4-2)28(23)15-16-12-13-18(19(14-16)25(31)32)17-10-6-5-7-11-17/h5-7,10-14,20,29H,3-4,8-9,15H2,1-2H3,(H2,26,30)(H,31,32)