[5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]-(4-nitrophenyl)methanone

Systemtic Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]-(4-nitrophenyl)methanone Openeye Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]tetrahydrofuran-2-yl]-(4-nitrophenyl)methanone CAS Name: [5-[6-(cyclopropylmethylamino)-9-purinyl]-2-oxolanyl]-(4-nitrophenyl)methanone IUPAC Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]oxolan-2-yl]-(4-nitrophenyl)methanone Traditional Name: [5-[6-(cyclopropylmethylamino)purin-9-yl]tetrahydrofuran-2-yl]-(4-nitrophenyl)methanone Formula: C20H20N6O4 MolecularWeight: 408.4106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC=NC3=C2N=CN3C4CCC(O4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC1CNC2=NC=NC3=C2N=CN3C4CCC(O4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O4/c27-18(13-3-5-14(6-4-13)26(28)29)15-7-8-16(30-15)25-11-24-17-19(21-9-12-1-2-12)22-10-23-20(17)25/h3-6,10-12,15-16H,1-2,7-9H2,(H,21,22,23)