tert-butyl 5-(2-chlorophenyl)carbonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate

Systemtic Name: tert-butyl 5-(2-chlorophenyl)carbonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Openeye Name: tert-butyl 5-(2-chlorobenzoyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate CAS Name: 5-[(2-chlorophenyl)-oxomethyl]-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(2-chlorobenzoyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Traditional Name: 5-(2-chlorobenzoyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester Formula: C22H20ClN3O3 MolecularWeight: 409.8655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C2CN(C3=CC=CC=C3N2C=N1)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)OC(=O)C1=C2CN(C3=CC=CC=C3N2C=N1)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H20ClN3O3/c1-22(2,3)29-21(28)19-18-12-25(20(27)14-8-4-5-9-15(14)23)16-10-6-7-11-17(16)26(18)13-24-19/h4-11,13H,12H2,1-3H3