1-(2-hydroxyethyl)-3-[3-[[2-hydroxyethyl(nitroso)carbamoyl]amino]-4-methyl-phenyl]-1-nitroso-urea

Systemtic Name: 1-(2-hydroxyethyl)-3-[3-[[2-hydroxyethyl(nitroso)carbamoyl]amino]-4-methyl-phenyl]-1-nitroso-urea Openeye Name: 1-(2-hydroxyethyl)-3-[3-[[2-hydroxyethyl(nitroso)carbamoyl]amino]-4-methyl-phenyl]-1-nitroso-urea CAS Name: 1-(2-hydroxyethyl)-3-[3-[[[2-hydroxyethyl(nitroso)amino]-oxomethyl]amino]-4-methylphenyl]-1-nitrosourea IUPAC Name: 1-(2-hydroxyethyl)-3-[3-[[2-hydroxyethyl(nitroso)carbamoyl]amino]-4-methylphenyl]-1-nitrosourea Traditional Name: 1-(2-hydroxyethyl)-3-[3-[[2-hydroxyethyl(nitroso)carbamoyl]amino]-4-methyl-phenyl]-1-nitroso-urea Formula: C13H18N6O6 MolecularWeight: 354.31862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CCO)N=O)NC(=O)N(CCO)N=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CCO)N=O)NC(=O)N(CCO)N=O

InChI

InChI=1S/C13H18N6O6/c1-9-2-3-10(14-12(22)18(16-24)4-6-20)8-11(9)15-13(23)19(17-25)5-7-21/h2-3,8,20-21H,4-7H2,1H3,(H,14,22)(H,15,23)