[4-[(2-bromophenyl)amino]-8-tert-butyl-imidazo[1,5-a]quinoxalin-3-yl]phosphonic acid

Systemtic Name: [4-[(2-bromophenyl)amino]-8-tert-butyl-imidazo[1,5-a]quinoxalin-3-yl]phosphonic acid Openeye Name: [4-(2-bromoanilino)-8-tert-butyl-imidazo[1,5-a]quinoxalin-3-yl]phosphonic acid CAS Name: [4-(2-bromoanilino)-8-tert-butyl-3-imidazo[1,5-a]quinoxalinyl]phosphonic acid IUPAC Name: [4-(2-bromoanilino)-8-tert-butylimidazo[1,5-a]quinoxalin-3-yl]phosphonic acid Traditional Name: [4-(2-bromoanilino)-8-tert-butyl-imidazo[1,5-a]quinoxalin-3-yl]phosphonic acid Formula: C20H20BrN4O3P MolecularWeight: 475.275561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N=C(C3=C(N=CN23)P(=O)(O)O)NC4=CC=CC=C4Br

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N=C(C3=C(N=CN23)P(=O)(O)O)NC4=CC=CC=C4Br

InChI

InChI=1S/C20H20BrN4O3P/c1-20(2,3)12-8-9-15-16(10-12)25-11-22-19(29(26,27)28)17(25)18(24-15)23-14-7-5-4-6-13(14)21/h4-11H,1-3H3,(H,23,24)(H2,26,27,28)