N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]ethanamide

Systemtic Name: N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]ethanamide Openeye Name: N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]acetamide CAS Name: N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]acetamide IUPAC Name: N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]acetamide Traditional Name: N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]acetamide Formula: C15H14N6O4 MolecularWeight: 342.30946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)OCCC3=CC=C(C=C3)[N+](=O)[O-])NC=N2

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)OCCC3=CC=C(C=C3)[N+](=O)[O-])NC=N2

InChI

InChI=1S/C15H14N6O4/c1-9(22)18-15-19-13-12(16-8-17-13)14(20-15)25-7-6-10-2-4-11(5-3-10)21(23)24/h2-5,8H,6-7H2,1H3,(H2,16,17,18,19,20,22)