N-(2-methylpropyl)-6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine

Systemtic Name: N-(2-methylpropyl)-6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine Openeye Name: N-isobutyl-6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine CAS Name: N-(2-methylpropyl)-6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine IUPAC Name: N-(2-methylpropyl)-6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine Traditional Name: isobutyl-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]amine Formula: C17H20N6O3 MolecularWeight: 356.3791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC2=C(C(=N1)OCCC3=CC=C(C=C3)[N+](=O)[O-])NC=N2

Isomeric SMILES

CC(C)CNC1=NC2=C(C(=N1)OCCC3=CC=C(C=C3)[N+](=O)[O-])NC=N2

InChI

InChI=1S/C17H20N6O3/c1-11(2)9-18-17-21-15-14(19-10-20-15)16(22-17)26-8-7-12-3-5-13(6-4-12)23(24)25/h3-6,10-11H,7-9H2,1-2H3,(H2,18,19,20,21,22)