1-(2-chloroethyl)-3-(3,4,6-trimethoxy-5-oxidanyl-1-oxidanylidene-hexan-2-yl)urea

Systemtic Name: 1-(2-chloroethyl)-3-(3,4,6-trimethoxy-5-oxidanyl-1-oxidanylidene-hexan-2-yl)urea Openeye Name: 1-(2-chloroethyl)-3-(1-formyl-4-hydroxy-2,3,5-trimethoxy-pentyl)urea CAS Name: 1-(2-chloroethyl)-3-(5-hydroxy-3,4,6-trimethoxy-1-oxohexan-2-yl)urea IUPAC Name: 1-(2-chloroethyl)-3-(5-hydroxy-3,4,6-trimethoxy-1-oxohexan-2-yl)urea Traditional Name: 1-(2-chloroethyl)-3-(1-formyl-4-hydroxy-2,3,5-trimethoxy-pentyl)urea Formula: C12H23ClN2O6 MolecularWeight: 326.77382

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Descriptors Computed from Structure

Canonical SMILES:

COCC(C(C(C(C=O)NC(=O)NCCCl)OC)OC)O

Isomeric SMILES

COCC(C(C(C(C=O)NC(=O)NCCCl)OC)OC)O

InChI

InChI=1S/C12H23ClN2O6/c1-19-7-9(17)11(21-3)10(20-2)8(6-16)15-12(18)14-5-4-13/h6,8-11,17H,4-5,7H2,1-3H3,(H2,14,15,18)