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

Systemtic Name: 2-[4-[[5-aminocarbonyl-2-butyl-4-(1-oxidanylbutyl)imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxybutyl)imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxybutyl)-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxybutyl)imidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxybutyl)imidazol-1-yl]methyl]phenyl]benzoic acid Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)N)C(CCC)O

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)N)C(CCC)O

InChI

InChI=1S/C26H31N3O4/c1-3-5-11-22-28-23(21(30)8-4-2)24(25(27)31)29(22)16-17-12-14-18(15-13-17)19-9-6-7-10-20(19)26(32)33/h6-7,9-10,12-15,21,30H,3-5,8,11,16H2,1-2H3,(H2,27,31)(H,32,33)