tert-butyl N-(2-cyano-3-fluoranyl-phenyl)carbamate

Systemtic Name: tert-butyl N-(2-cyano-3-fluoranyl-phenyl)carbamate Openeye Name: tert-butyl N-(2-cyano-3-fluoro-phenyl)carbamate CAS Name: N-(2-cyano-3-fluorophenyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2-cyano-3-fluorophenyl)carbamate Traditional Name: N-(2-cyano-3-fluoro-phenyl)carbamic acid tert-butyl ester Formula: C12H13FN2O2 MolecularWeight: 236.242223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C(=CC=C1)F)C#N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C(=CC=C1)F)C#N

InChI

InChI=1S/C12H13FN2O2/c1-12(2,3)17-11(16)15-10-6-4-5-9(13)8(10)7-14/h4-6H,1-3H3,(H,15,16)