2-(4-nitrophenoxy)-N-(7H-purin-6-yl)propanamide

Systemtic Name: 2-(4-nitrophenoxy)-N-(7H-purin-6-yl)propanamide Openeye Name: 2-(4-nitrophenoxy)-N-(7H-purin-6-yl)propanamide CAS Name: 2-(4-nitrophenoxy)-N-(7H-purin-6-yl)propanamide IUPAC Name: 2-(4-nitrophenoxy)-N-(7H-purin-6-yl)propanamide Traditional Name: 2-(4-nitrophenoxy)-N-(7H-purin-6-yl)propionamide Formula: C14H12N6O4 MolecularWeight: 328.28288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=NC2=C1NC=N2)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NC=NC2=C1NC=N2)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N6O4/c1-8(24-10-4-2-9(3-5-10)20(22)23)14(21)19-13-11-12(16-6-15-11)17-7-18-13/h2-8H,1H3,(H2,15,16,17,18,19,21)