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

Systemtic Name: N4-[[3-[3-(diethylamino)propoxy]phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine Openeye Name: N4-[[3-[3-(diethylamino)propoxy]phenyl]methyl]-N7-ethyl-6-nitro-quinazoline-4,7-diamine CAS Name: N4-[[3-[3-(diethylamino)propoxy]phenyl]methyl]-N7-ethyl-6-nitroquinazoline-4,7-diamine IUPAC Name: 4-N-[[3-[3-(diethylamino)propoxy]phenyl]methyl]-7-N-ethyl-6-nitroquinazoline-4,7-diamine Traditional Name: diethyl-[3-[3-[[[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=C3)OCCCN(CC)CC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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