methyl 3-(1-butylimidazol-2-yl)-4,4,4-tris(fluoranyl)-2-methylidene-3-oxidanyl-butanoate

Systemtic Name: methyl 3-(1-butylimidazol-2-yl)-4,4,4-tris(fluoranyl)-2-methylidene-3-oxidanyl-butanoate Openeye Name: methyl 3-(1-butylimidazol-2-yl)-4,4,4-trifluoro-3-hydroxy-2-methylene-butanoate CAS Name: 3-(1-butyl-2-imidazolyl)-4,4,4-trifluoro-3-hydroxy-2-methylenebutanoic acid methyl ester IUPAC Name: methyl 3-(1-butylimidazol-2-yl)-4,4,4-trifluoro-3-hydroxy-2-methylidenebutanoate Traditional Name: 2-[1-(1-butylimidazol-2-yl)-2,2,2-trifluoro-1-hydroxy-ethyl]acrylic acid methyl ester Formula: C13H17F3N2O3 MolecularWeight: 306.28089

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CN=C1C(C(=C)C(=O)OC)(C(F)(F)F)O

Isomeric SMILES

CCCCN1C=CN=C1C(C(=C)C(=O)OC)(C(F)(F)F)O

InChI

InChI=1S/C13H17F3N2O3/c1-4-5-7-18-8-6-17-11(18)12(20,13(14,15)16)9(2)10(19)21-3/h6,8,20H,2,4-5,7H2,1,3H3