3-[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-1-methyl-1-nitroso-urea

Systemtic Name: 3-[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-1-methyl-1-nitroso-urea Openeye Name: 3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-1-methyl-1-nitroso-urea CAS Name: 3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methyl]-1-methyl-1-nitrosourea IUPAC Name: 3-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-1-methyl-1-nitrosourea Traditional Name: 3-[(5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl)methyl]-1-methyl-1-nitroso-urea Formula: C12H16N8O5 MolecularWeight: 352.30604

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O)N=O

Isomeric SMILES

CN(C(=O)NCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O)N=O

InChI

InChI=1S/C12H16N8O5/c1-19(18-24)12(23)14-2-5-7(21)8(22)11(25-5)20-4-17-6-9(13)15-3-16-10(6)20/h3-5,7-8,11,21-22H,2H2,1H3,(H,14,23)(H2,13,15,16)