2-[4-[(2-butyl-4-iodanyl-5-methanoyl-imidazol-1-yl)methyl]phenyl]-2-cyclopentyl-ethanoic acid

Systemtic Name: 2-[4-[(2-butyl-4-iodanyl-5-methanoyl-imidazol-1-yl)methyl]phenyl]-2-cyclopentyl-ethanoic acid Openeye Name: 2-[4-[(2-butyl-5-formyl-4-iodo-imidazol-1-yl)methyl]phenyl]-2-cyclopentyl-acetic acid CAS Name: 2-[4-[(2-butyl-5-formyl-4-iodo-1-imidazolyl)methyl]phenyl]-2-cyclopentylacetic acid IUPAC Name: 2-[4-[(2-butyl-5-formyl-4-iodoimidazol-1-yl)methyl]phenyl]-2-cyclopentylacetic acid Traditional Name: 2-[4-[(2-butyl-5-formyl-4-iodo-imidazol-1-yl)methyl]phenyl]-2-cyclopentyl-acetic acid Formula: C22H27IN2O3 MolecularWeight: 494.36585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(C3CCCC3)C(=O)O)C=O)I

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(C3CCCC3)C(=O)O)C=O)I

InChI

InChI=1S/C22H27IN2O3/c1-2-3-8-19-24-21(23)18(14-26)25(19)13-15-9-11-17(12-10-15)20(22(27)28)16-6-4-5-7-16/h9-12,14,16,20H,2-8,13H2,1H3,(H,27,28)