2-[2-(4-chloranylphenoxy)-2-imidazol-1-yl-ethanoyl]-2-propan-2-yl-hexanoic acid

Systemtic Name: 2-[2-(4-chloranylphenoxy)-2-imidazol-1-yl-ethanoyl]-2-propan-2-yl-hexanoic acid Openeye Name: 2-[2-(4-chlorophenoxy)-2-imidazol-1-yl-acetyl]-2-isopropyl-hexanoic acid CAS Name: 2-[2-(4-chlorophenoxy)-2-(1-imidazolyl)-1-oxoethyl]-2-propan-2-ylhexanoic acid IUPAC Name: 2-[2-(4-chlorophenoxy)-2-imidazol-1-ylacetyl]-2-propan-2-ylhexanoic acid Traditional Name: 2-[2-(4-chlorophenoxy)-2-imidazol-1-yl-acetyl]-2-isopropyl-hexanoic acid Formula: C20H25ClN2O4 MolecularWeight: 392.8765

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)C)(C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCCC(C(C)C)(C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C20H25ClN2O4/c1-4-5-10-20(14(2)3,19(25)26)17(24)18(23-12-11-22-13-23)27-16-8-6-15(21)7-9-16/h6-9,11-14,18H,4-5,10H2,1-3H3,(H,25,26)