1-(2-chloroethyl)-3-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]-1-nitroso-urea

Systemtic Name: 1-(2-chloroethyl)-3-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-1-nitroso-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)urea CAS Name: 1-(2-chloroethyl)-1-nitroso-3-(3,4,5-trihydroxy-6-methyl-2-oxanyl)urea IUPAC Name: 1-(2-chloroethyl)-1-nitroso-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)urea Traditional Name: 1-(2-chloroethyl)-1-nitroso-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)urea Formula: C9H16ClN3O6 MolecularWeight: 297.69284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)NC(=O)N(CCCl)N=O)O)O)O

Isomeric SMILES

CC1C(C(C(C(O1)NC(=O)N(CCCl)N=O)O)O)O

InChI

InChI=1S/C9H16ClN3O6/c1-4-5(14)6(15)7(16)8(19-4)11-9(17)13(12-18)3-2-10/h4-8,14-16H,2-3H2,1H3,(H,11,17)