7-methyl-8-(4-nitrophenyl)-N-(phenylmethyl)purin-6-amine

Systemtic Name: 7-methyl-8-(4-nitrophenyl)-N-(phenylmethyl)purin-6-amine Openeye Name: N-benzyl-7-methyl-8-(4-nitrophenyl)purin-6-amine CAS Name: 7-methyl-8-(4-nitrophenyl)-N-(phenylmethyl)-6-purinamine IUPAC Name: N-benzyl-7-methyl-8-(4-nitrophenyl)purin-6-amine Traditional Name: benzyl-[7-methyl-8-(4-nitrophenyl)purin-6-yl]amine Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=CN=C2NCC3=CC=CC=C3)N=C1C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C2=C(N=CN=C2NCC3=CC=CC=C3)N=C1C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N6O2/c1-24-16-17(20-11-13-5-3-2-4-6-13)21-12-22-18(16)23-19(24)14-7-9-15(10-8-14)25(26)27/h2-10,12H,11H2,1H3,(H,20,21,22)