3-[1,3-bis(oxidanyl)propan-2-yl]-1-(2-chloroethyl)-1-nitroso-urea

Systemtic Name: 3-[1,3-bis(oxidanyl)propan-2-yl]-1-(2-chloroethyl)-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-[2-hydroxy-1-(hydroxymethyl)ethyl]-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-(1,3-dihydroxypropan-2-yl)-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-(1,3-dihydroxypropan-2-yl)-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-(2-hydroxy-1-methylol-ethyl)-1-nitroso-urea Formula: C6H12ClN3O4 MolecularWeight: 225.63018

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Descriptors Computed from Structure

Canonical SMILES:

C(CCl)N(C(=O)NC(CO)CO)N=O

Isomeric SMILES

C(CCl)N(C(=O)NC(CO)CO)N=O

InChI

InChI=1S/C6H12ClN3O4/c7-1-2-10(9-14)6(13)8-5(3-11)4-12/h5,11-12H,1-4H2,(H,8,13)