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

Systemtic Name: 5-[(4-aminocarbonyl-2-butyl-5-chloranyl-imidazol-1-yl)methyl]-2-phenyl-benzoic acid Openeye Name: 5-[(2-butyl-4-carbamoyl-5-chloro-imidazol-1-yl)methyl]-2-phenyl-benzoic acid CAS Name: 5-[(2-butyl-4-carbamoyl-5-chloro-1-imidazolyl)methyl]-2-phenylbenzoic acid IUPAC Name: 5-[(2-butyl-4-carbamoyl-5-chloroimidazol-1-yl)methyl]-2-phenylbenzoic acid Traditional Name: 5-[(2-butyl-4-carbamoyl-5-chloro-imidazol-1-yl)methyl]-2-phenyl-benzoic acid Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O3/c1-2-3-9-18-25-19(21(24)27)20(23)26(18)13-14-10-11-16(17(12-14)22(28)29)15-7-5-4-6-8-15/h4-8,10-12H,2-3,9,13H2,1H3,(H2,24,27)(H,28,29)