N4-[[3-(2-diethylaminoethyloxy)phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine

Systemtic Name: N4-[[3-(2-diethylaminoethyloxy)phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine Openeye Name: N4-[[3-(2-diethylaminoethyloxy)phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine CAS Name: N4-[[3-(2-diethylaminoethyloxy)phenyl]methyl]-N7-ethyl-6-nitroquinazoline-4,7-diamine IUPAC Name: 4-N-[[3-(2-diethylaminoethyloxy)phenyl]methyl]-7-N-ethyl-6-nitroquinazoline-4,7-diamine Traditional Name: diethyl-[2-[3-[[[7-(ethylamino)-6-nitro-quinazolin-4-yl]amino]methyl]phenoxy]ethyl]amine Formula: C23H30N6O3 MolecularWeight: 438.5227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N6O3/c1-4-24-21-14-20-19(13-22(21)29(30)31)23(27-16-26-20)25-15-17-8-7-9-18(12-17)32-11-10-28(5-2)6-3/h7-9,12-14,16,24H,4-6,10-11,15H2,1-3H3,(H,25,26,27)