tert-butyl [(4-nitrophenyl)-di(quinolin-2-yl)methyl] carbonate

Systemtic Name: tert-butyl [(4-nitrophenyl)-di(quinolin-2-yl)methyl] carbonate Openeye Name: tert-butyl [(4-nitrophenyl)-bis(2-quinolyl)methyl] carbonate CAS Name: carbonic acid tert-butyl [(4-nitrophenyl)-bis(2-quinolinyl)methyl] ester IUPAC Name: tert-butyl [(4-nitrophenyl)-di(quinolin-2-yl)methyl] carbonate Traditional Name: carbonic acid tert-butyl [(4-nitrophenyl)-bis(2-quinolyl)methyl] ester Formula: C30H25N3O5 MolecularWeight: 507.5366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC(C1=CC=C(C=C1)[N+](=O)[O-])(C2=NC3=CC=CC=C3C=C2)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC(C)(C)OC(=O)OC(C1=CC=C(C=C1)[N+](=O)[O-])(C2=NC3=CC=CC=C3C=C2)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C30H25N3O5/c1-29(2,3)37-28(34)38-30(22-14-16-23(17-15-22)33(35)36,26-18-12-20-8-4-6-10-24(20)31-26)27-19-13-21-9-5-7-11-25(21)32-27/h4-19H,1-3H3