1-(2-chloroethyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]-1-nitroso-urea

Systemtic Name: 1-(2-chloroethyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl]-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-[(3-hydroxy-2-methyl-5-methylol-4-pyridyl)methyl]-1-nitroso-urea Formula: C11H15ClN4O4 MolecularWeight: 302.7142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNC(=O)N(CCCl)N=O)CO

Isomeric SMILES

CC1=NC=C(C(=C1O)CNC(=O)N(CCCl)N=O)CO

InChI

InChI=1S/C11H15ClN4O4/c1-7-10(18)9(8(6-17)4-13-7)5-14-11(19)16(15-20)3-2-12/h4,17-18H,2-3,5-6H2,1H3,(H,14,19)