tert-butyl [3-(cyanomethyl)-4-oxidanyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-(cyanomethyl)-4-oxidanyl-phenyl] carbonate Openeye Name: tert-butyl [3-(cyanomethyl)-4-hydroxy-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-(cyanomethyl)-4-hydroxyphenyl] ester IUPAC Name: tert-butyl [3-(cyanomethyl)-4-hydroxyphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-(cyanomethyl)-4-hydroxy-phenyl] ester Formula: C13H15NO4 MolecularWeight: 249.2625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=CC(=C(C=C1)O)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)OC1=CC(=C(C=C1)O)CC#N

InChI

InChI=1S/C13H15NO4/c1-13(2,3)18-12(16)17-10-4-5-11(15)9(8-10)6-7-14/h4-5,8,15H,6H2,1-3H3