N-(3-bromophenyl)-7-(1-morpholin-4-ylpropoxy)-6-nitro-quinazolin-4-amine

Systemtic Name: N-(3-bromophenyl)-7-(1-morpholin-4-ylpropoxy)-6-nitro-quinazolin-4-amine Openeye Name: N-(3-bromophenyl)-7-(1-morpholinopropoxy)-6-nitro-quinazolin-4-amine CAS Name: N-(3-bromophenyl)-7-[1-(4-morpholinyl)propoxy]-6-nitro-4-quinazolinamine IUPAC Name: N-(3-bromophenyl)-7-(1-morpholin-4-ylpropoxy)-6-nitroquinazolin-4-amine Traditional Name: (3-bromophenyl)-[7-(1-morpholinopropoxy)-6-nitro-quinazolin-4-yl]amine Formula: C21H22BrN5O4 MolecularWeight: 488.33448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCOCC1)OC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)[N+](=O)[O-]

Isomeric SMILES

CCC(N1CCOCC1)OC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H22BrN5O4/c1-2-20(26-6-8-30-9-7-26)31-19-12-17-16(11-18(19)27(28)29)21(24-13-23-17)25-15-5-3-4-14(22)10-15/h3-5,10-13,20H,2,6-9H2,1H3,(H,23,24,25)