6-[(4-methoxy-2-nitro-phenyl)methoxy]-7H-purine

Systemtic Name: 6-[(4-methoxy-2-nitro-phenyl)methoxy]-7H-purine Openeye Name: 6-[(4-methoxy-2-nitro-phenyl)methoxy]-7H-purine CAS Name: 6-[(4-methoxy-2-nitrophenyl)methoxy]-7H-purine IUPAC Name: 6-[(4-methoxy-2-nitrophenyl)methoxy]-7H-purine Traditional Name: 6-(4-methoxy-2-nitro-benzyl)oxy-7H-purine Formula: C13H11N5O4 MolecularWeight: 301.25754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)COC2=NC=NC3=C2NC=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)COC2=NC=NC3=C2NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O4/c1-21-9-3-2-8(10(4-9)18(19)20)5-22-13-11-12(15-6-14-11)16-7-17-13/h2-4,6-7H,5H2,1H3,(H,14,15,16,17)