3-(2-chloroethyl)-1-nitroso-1-(2-oxidanylidenepropyl)urea

Systemtic Name: 3-(2-chloroethyl)-1-nitroso-1-(2-oxidanylidenepropyl)urea Openeye Name: 1-acetonyl-3-(2-chloroethyl)-1-nitroso-urea CAS Name: 3-(2-chloroethyl)-1-nitroso-1-(2-oxopropyl)urea IUPAC Name: 3-(2-chloroethyl)-1-nitroso-1-(2-oxopropyl)urea Traditional Name: 1-acetonyl-3-(2-chloroethyl)-1-nitroso-urea Formula: C6H10ClN3O3 MolecularWeight: 207.6149

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN(C(=O)NCCCl)N=O

Isomeric SMILES

CC(=O)CN(C(=O)NCCCl)N=O

InChI

InChI=1S/C6H10ClN3O3/c1-5(11)4-10(9-13)6(12)8-3-2-7/h2-4H2,1H3,(H,8,12)