1-methyl-1-nitroso-3-[7-(6-oxidanylidene-3H-purin-9-yl)heptyl]urea

Systemtic Name: 1-methyl-1-nitroso-3-[7-(6-oxidanylidene-3H-purin-9-yl)heptyl]urea Openeye Name: 1-methyl-1-nitroso-3-[7-(6-oxo-3H-purin-9-yl)heptyl]urea CAS Name: 1-methyl-1-nitroso-3-[7-(6-oxo-3H-purin-9-yl)heptyl]urea IUPAC Name: 1-methyl-1-nitroso-3-[7-(6-oxo-3H-purin-9-yl)heptyl]urea Traditional Name: 3-[7-(6-keto-3H-purin-9-yl)heptyl]-1-methyl-1-nitroso-urea Formula: C14H21N7O3 MolecularWeight: 335.36164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NCCCCCCCN1C=NC2=C1NC=NC2=O)N=O

Isomeric SMILES

CN(C(=O)NCCCCCCCN1C=NC2=C1NC=NC2=O)N=O

InChI

InChI=1S/C14H21N7O3/c1-20(19-24)14(23)15-7-5-3-2-4-6-8-21-10-18-11-12(21)16-9-17-13(11)22/h9-10H,2-8H2,1H3,(H,15,23)(H,16,17,22)