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

Systemtic Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]urea Openeye Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]urea CAS Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]urea IUPAC Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]urea Traditional Name: 1-(2-chloroethyl)-3-[5-(dimethylaminomethyl)-2,2-dimethyl-1,3-dioxan-5-yl]urea Formula: C12H24ClN3O3 MolecularWeight: 293.79026

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(CN(C)C)NC(=O)NCCCl)C

Isomeric SMILES

CC1(OCC(CO1)(CN(C)C)NC(=O)NCCCl)C

InChI

InChI=1S/C12H24ClN3O3/c1-11(2)18-8-12(9-19-11,7-16(3)4)15-10(17)14-6-5-13/h5-9H2,1-4H3,(H2,14,15,17)