2-[4-[[5-aminocarbonyl-2-butyl-4-(2,2-dimethyl-1-oxidanyl-propyl)imidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[5-aminocarbonyl-2-butyl-4-(2,2-dimethyl-1-oxidanyl-propyl)imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxy-2,2-dimethyl-propyl)imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxy-2,2-dimethylpropyl)-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxy-2,2-dimethylpropyl)imidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[2-butyl-5-carbamoyl-4-(1-hydroxy-2,2-dimethyl-propyl)imidazol-1-yl]methyl]phenyl]benzoic acid Formula: C27H33N3O4 MolecularWeight: 463.56862

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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(C(C)(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C27H33N3O4/c1-5-6-11-21-29-22(24(31)27(2,3)4)23(25(28)32)30(21)16-17-12-14-18(15-13-17)19-9-7-8-10-20(19)26(33)34/h7-10,12-15,24,31H,5-6,11,16H2,1-4H3,(H2,28,32)(H,33,34)