tert-butyl 7-chloranyl-5-piperazin-1-ylcarbonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate

Systemtic Name: tert-butyl 7-chloranyl-5-piperazin-1-ylcarbonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Openeye Name: tert-butyl 7-chloro-5-(piperazine-1-carbonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate CAS Name: 7-chloro-5-[oxo(1-piperazinyl)methyl]-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-chloro-5-(piperazine-1-carbonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Traditional Name: 7-chloro-5-(piperazine-1-carbonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester Formula: C20H24ClN5O3 MolecularWeight: 417.88926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C2CN(C3=C(N2C=N1)C=CC(=C3)Cl)C(=O)N4CCNCC4

Isomeric SMILES

CC(C)(C)OC(=O)C1=C2CN(C3=C(N2C=N1)C=CC(=C3)Cl)C(=O)N4CCNCC4

InChI

InChI=1S/C20H24ClN5O3/c1-20(2,3)29-18(27)17-16-11-25(19(28)24-8-6-22-7-9-24)15-10-13(21)4-5-14(15)26(16)12-23-17/h4-5,10,12,22H,6-9,11H2,1-3H3