5-[4-[(2-carboxy-2-methyl-1,3-dioxan-5-yl)oxycarbonylamino]butylcarbamoyloxy]-2-methyl-1,3-dioxane-2-carboxylic acid

Systemtic Name: 5-[4-[(2-carboxy-2-methyl-1,3-dioxan-5-yl)oxycarbonylamino]butylcarbamoyloxy]-2-methyl-1,3-dioxane-2-carboxylic acid Openeye Name: 5-[4-[(2-carboxy-2-methyl-1,3-dioxan-5-yl)oxycarbonylamino]butylcarbamoyloxy]-2-methyl-1,3-dioxane-2-carboxylic acid CAS Name: 5-[[4-[[(2-carboxy-2-methyl-1,3-dioxan-5-yl)oxy-oxomethyl]amino]butylamino]-oxomethoxy]-2-methyl-1,3-dioxane-2-carboxylic acid IUPAC Name: 5-[4-[(2-carboxy-2-methyl-1,3-dioxan-5-yl)oxycarbonylamino]butylcarbamoyloxy]-2-methyl-1,3-dioxane-2-carboxylic acid Traditional Name: 5-[4-[(2-carboxy-2-methyl-1,3-dioxan-5-yl)oxycarbonylamino]butylcarbamoyloxy]-2-methyl-1,3-dioxane-2-carboxylic acid Formula: C18H28N2O12 MolecularWeight: 464.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)OC(=O)NCCCCNC(=O)OC2COC(OC2)(C)C(=O)O)C(=O)O

Isomeric SMILES

CC1(OCC(CO1)OC(=O)NCCCCNC(=O)OC2COC(OC2)(C)C(=O)O)C(=O)O

InChI

InChI=1S/C18H28N2O12/c1-17(13(21)22)27-7-11(8-28-17)31-15(25)19-5-3-4-6-20-16(26)32-12-9-29-18(2,14(23)24)30-10-12/h11-12H,3-10H2,1-2H3,(H,19,25)(H,20,26)(H,21,22)(H,23,24)