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

Systemtic Name: 1-(2-chloroethyl)-3-(2-methylpropyl)-1-nitroso-3-[3,4,5-tris(oxidanyl)oxan-2-yl]urea Openeye Name: 1-(2-chloroethyl)-3-isobutyl-1-nitroso-3-(3,4,5-trihydroxytetrahydropyran-2-yl)urea CAS Name: 1-(2-chloroethyl)-3-(2-methylpropyl)-1-nitroso-3-(3,4,5-trihydroxy-2-oxanyl)urea IUPAC Name: 1-(2-chloroethyl)-3-(2-methylpropyl)-1-nitroso-3-(3,4,5-trihydroxyoxan-2-yl)urea Traditional Name: 1-(2-chloroethyl)-3-isobutyl-1-nitroso-3-(3,4,5-trihydroxytetrahydropyran-2-yl)urea Formula: C12H22ClN3O6 MolecularWeight: 339.77258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1C(C(C(CO1)O)O)O)C(=O)N(CCCl)N=O

Isomeric SMILES

CC(C)CN(C1C(C(C(CO1)O)O)O)C(=O)N(CCCl)N=O

InChI

InChI=1S/C12H22ClN3O6/c1-7(2)5-15(12(20)16(14-21)4-3-13)11-10(19)9(18)8(17)6-22-11/h7-11,17-19H,3-6H2,1-2H3