6-(furan-2-yl)-9-[(4-nitrophenyl)methyl]purine

Systemtic Name: 6-(furan-2-yl)-9-[(4-nitrophenyl)methyl]purine Openeye Name: 6-(2-furyl)-9-[(4-nitrophenyl)methyl]purine CAS Name: 6-(2-furanyl)-9-[(4-nitrophenyl)methyl]purine IUPAC Name: 6-(furan-2-yl)-9-[(4-nitrophenyl)methyl]purine Traditional Name: 6-(2-furyl)-9-(4-nitrobenzyl)purine Formula: C16H11N5O3 MolecularWeight: 321.29024

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C3C(=NC=N2)N(C=N3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C2=C3C(=NC=N2)N(C=N3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N5O3/c22-21(23)12-5-3-11(4-6-12)8-20-10-19-15-14(13-2-1-7-24-13)17-9-18-16(15)20/h1-7,9-10H,8H2