6-(4-methylphenyl)-7-(2-nitrophenyl)purine

Systemtic Name: 6-(4-methylphenyl)-7-(2-nitrophenyl)purine Openeye Name: 7-(2-nitrophenyl)-6-(p-tolyl)purine CAS Name: 6-(4-methylphenyl)-7-(2-nitrophenyl)purine IUPAC Name: 6-(4-methylphenyl)-7-(2-nitrophenyl)purine Traditional Name: 7-(2-nitrophenyl)-6-(p-tolyl)purine Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C(=NC=N2)N=CN3C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C(=NC=N2)N=CN3C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O2/c1-12-6-8-13(9-7-12)16-17-18(20-10-19-16)21-11-22(17)14-4-2-3-5-15(14)23(24)25/h2-11H,1H3