1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]-1-nitroso-urea

Systemtic Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]-1-nitroso-urea Formula: C12H23ClN4O4 MolecularWeight: 322.78842

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(CN(C)C)NC(=O)N(CCCl)N=O)C

Isomeric SMILES

CC1(OCC(CO1)(CN(C)C)NC(=O)N(CCCl)N=O)C

InChI

InChI=1S/C12H23ClN4O4/c1-11(2)20-8-12(9-21-11,7-16(3)4)14-10(18)17(15-19)6-5-13/h5-9H2,1-4H3,(H,14,18)