tert-butyl N-(1-oxidanylidene-3-phenyl-isoquinolin-2-yl)carbamate

Systemtic Name: tert-butyl N-(1-oxidanylidene-3-phenyl-isoquinolin-2-yl)carbamate Openeye Name: tert-butyl N-(1-oxo-3-phenyl-2-isoquinolyl)carbamate CAS Name: N-(1-oxo-3-phenyl-2-isoquinolinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-oxo-3-phenylisoquinolin-2-yl)carbamate Traditional Name: N-(1-keto-3-phenyl-2-isoquinolyl)carbamic acid tert-butyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C(=CC2=CC=CC=C2C1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NN1C(=CC2=CC=CC=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3/c1-20(2,3)25-19(24)21-22-17(14-9-5-4-6-10-14)13-15-11-7-8-12-16(15)18(22)23/h4-13H,1-3H3,(H,21,24)