6-nitro-7-[4-(oxan-2-yloxy)butoxy]-N-(1-phenylethyl)quinazolin-4-amine

Systemtic Name: 6-nitro-7-[4-(oxan-2-yloxy)butoxy]-N-(1-phenylethyl)quinazolin-4-amine Openeye Name: 6-nitro-N-(1-phenylethyl)-7-(4-tetrahydropyran-2-yloxybutoxy)quinazolin-4-amine CAS Name: 6-nitro-7-[4-(2-oxanyloxy)butoxy]-N-(1-phenylethyl)-4-quinazolinamine IUPAC Name: 6-nitro-7-[4-(oxan-2-yloxy)butoxy]-N-(1-phenylethyl)quinazolin-4-amine Traditional Name: [6-nitro-7-(4-tetrahydropyran-2-yloxybutoxy)quinazolin-4-yl]-(1-phenylethyl)amine Formula: C25H30N4O5 MolecularWeight: 466.5295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCCCOC4CCCCO4

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCCCOC4CCCCO4

InChI

InChI=1S/C25H30N4O5/c1-18(19-9-3-2-4-10-19)28-25-20-15-22(29(30)31)23(16-21(20)26-17-27-25)32-12-7-8-14-34-24-11-5-6-13-33-24/h2-4,9-10,15-18,24H,5-8,11-14H2,1H3,(H,26,27,28)