methyl N-[[2-fluoranyl-5-(3-oxidanylbut-1-ynyl)phenyl]methyl]carbamate

Systemtic Name: methyl N-[[2-fluoranyl-5-(3-oxidanylbut-1-ynyl)phenyl]methyl]carbamate Openeye Name: methyl N-[[2-fluoro-5-(3-hydroxybut-1-ynyl)phenyl]methyl]carbamate CAS Name: N-[[2-fluoro-5-(3-hydroxybut-1-ynyl)phenyl]methyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-fluoro-5-(3-hydroxybut-1-ynyl)phenyl]methyl]carbamate Traditional Name: N-[2-fluoro-5-(3-hydroxybut-1-ynyl)benzyl]carbamic acid methyl ester Formula: C13H14FNO3 MolecularWeight: 251.253563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=C(C=C1)F)CNC(=O)OC)O

Isomeric SMILES

CC(C#CC1=CC(=C(C=C1)F)CNC(=O)OC)O

InChI

InChI=1S/C13H14FNO3/c1-9(16)3-4-10-5-6-12(14)11(7-10)8-15-13(17)18-2/h5-7,9,16H,8H2,1-2H3,(H,15,17)