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

Systemtic Name: N7-ethyl-N4-[[2-(2-morpholin-4-ylethylamino)phenyl]methyl]-6-nitro-quinazoline-4,7-diamine Openeye Name: N7-ethyl-N4-[[2-(2-morpholinoethylamino)phenyl]methyl]-6-nitro-quinazoline-4,7-diamine CAS Name: N7-ethyl-N4-[[2-[2-(4-morpholinyl)ethylamino]phenyl]methyl]-6-nitroquinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-4-N-[[2-(2-morpholin-4-ylethylamino)phenyl]methyl]-6-nitroquinazoline-4,7-diamine Traditional Name: ethyl-[4-[[2-(2-morpholinoethylamino)benzyl]amino]-6-nitro-quinazolin-7-yl]amine Formula: C23H29N7O3 MolecularWeight: 451.52146

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3NCCN4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3NCCN4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H29N7O3/c1-2-24-21-14-20-18(13-22(21)30(31)32)23(28-16-27-20)26-15-17-5-3-4-6-19(17)25-7-8-29-9-11-33-12-10-29/h3-6,13-14,16,24-25H,2,7-12,15H2,1H3,(H,26,27,28)