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

Systemtic Name: N4-[[2-[3-(diethylamino)propoxy]phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine Openeye Name: N4-[[2-[3-(diethylamino)propoxy]phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine CAS Name: N4-[[2-[3-(diethylamino)propoxy]phenyl]methyl]-N7-ethyl-6-nitroquinazoline-4,7-diamine IUPAC Name: 4-N-[[2-[3-(diethylamino)propoxy]phenyl]methyl]-7-N-ethyl-6-nitroquinazoline-4,7-diamine Traditional Name: diethyl-[3-[2-[[[7-(ethylamino)-6-nitro-quinazolin-4-yl]amino]methyl]phenoxy]propyl]amine Formula: C24H32N6O3 MolecularWeight: 452.54928

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3OCCCN(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3OCCCN(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C24H32N6O3/c1-4-25-21-15-20-19(14-22(21)30(31)32)24(28-17-27-20)26-16-18-10-7-8-11-23(18)33-13-9-12-29(5-2)6-3/h7-8,10-11,14-15,17,25H,4-6,9,12-13,16H2,1-3H3,(H,26,27,28)