N7-ethyl-N4-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]-6-nitro-quinazoline-4,7-diamine

Systemtic Name: N7-ethyl-N4-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]-6-nitro-quinazoline-4,7-diamine Openeye Name: N7-ethyl-N4-[[4-(2-morpholinoethoxy)phenyl]methyl]-6-nitro-quinazoline-4,7-diamine CAS Name: N7-ethyl-N4-[[4-[2-(4-morpholinyl)ethoxy]phenyl]methyl]-6-nitroquinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-4-N-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]-6-nitroquinazoline-4,7-diamine Traditional Name: ethyl-[4-[[4-(2-morpholinoethoxy)benzyl]amino]-6-nitro-quinazolin-7-yl]amine Formula: C23H28N6O4 MolecularWeight: 452.50622

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=C(C=C3)OCCN4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=C(C=C3)OCCN4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N6O4/c1-2-24-21-14-20-19(13-22(21)29(30)31)23(27-16-26-20)25-15-17-3-5-18(6-4-17)33-12-9-28-7-10-32-11-8-28/h3-6,13-14,16,24H,2,7-12,15H2,1H3,(H,25,26,27)