methyl 2-[2-(2-ethyl-2-methyl-butyl)-1,3-benzoxazol-5-yl]-2-fluoranyl-ethanoate

Systemtic Name: methyl 2-[2-(2-ethyl-2-methyl-butyl)-1,3-benzoxazol-5-yl]-2-fluoranyl-ethanoate Openeye Name: methyl 2-[2-(2-ethyl-2-methyl-butyl)-1,3-benzoxazol-5-yl]-2-fluoro-acetate CAS Name: 2-[2-(2-ethyl-2-methylbutyl)-1,3-benzoxazol-5-yl]-2-fluoroacetic acid methyl ester IUPAC Name: methyl 2-[2-(2-ethyl-2-methylbutyl)-1,3-benzoxazol-5-yl]-2-fluoroacetate Traditional Name: 2-[2-(2-ethyl-2-methyl-butyl)-1,3-benzoxazol-5-yl]-2-fluoro-acetic acid methyl ester Formula: C17H22FNO3 MolecularWeight: 307.359883

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC)CC1=NC2=C(O1)C=CC(=C2)C(C(=O)OC)F

Isomeric SMILES

CCC(C)(CC)CC1=NC2=C(O1)C=CC(=C2)C(C(=O)OC)F

InChI

InChI=1S/C17H22FNO3/c1-5-17(3,6-2)10-14-19-12-9-11(7-8-13(12)22-14)15(18)16(20)21-4/h7-9,15H,5-6,10H2,1-4H3