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

Systemtic Name: 2-methyl-N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]propanamide Openeye Name: 2-methyl-N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]propanamide CAS Name: 2-methyl-N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]propanamide IUPAC Name: 2-methyl-N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]propanamide Traditional Name: 2-methyl-N-[6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]propionamide Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N6O4/c1-10(2)15(24)21-17-20-14-13(18-9-19-14)16(22-17)27-8-7-11-3-5-12(6-4-11)23(25)26/h3-6,9-10H,7-8H2,1-2H3,(H2,18,19,20,21,22,24)