1-(2-chloroethyl)-3-[2-(hydroxymethyl)-3-methyl-1-oxidanyl-butan-2-yl]-1-nitroso-urea

Systemtic Name: 1-(2-chloroethyl)-3-[2-(hydroxymethyl)-3-methyl-1-oxidanyl-butan-2-yl]-1-nitroso-urea Openeye Name: 3-[1,1-bis(hydroxymethyl)-2-methyl-propyl]-1-(2-chloroethyl)-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-[1-hydroxy-2-(hydroxymethyl)-3-methylbutan-2-yl]-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-[1-hydroxy-2-(hydroxymethyl)-3-methylbutan-2-yl]-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-(2-methyl-1,1-dimethylol-propyl)-1-nitroso-urea Formula: C9H18ClN3O4 MolecularWeight: 267.70992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)(CO)NC(=O)N(CCCl)N=O

Isomeric SMILES

CC(C)C(CO)(CO)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C9H18ClN3O4/c1-7(2)9(5-14,6-15)11-8(16)13(12-17)4-3-10/h7,14-15H,3-6H2,1-2H3,(H,11,16)