methyl 5-[5-(cyclohexylcarbonylamino)-6-oxidanylidene-heptyl]-2-methyl-1,3-dioxane-2-carboxylate

Systemtic Name: methyl 5-[5-(cyclohexylcarbonylamino)-6-oxidanylidene-heptyl]-2-methyl-1,3-dioxane-2-carboxylate Openeye Name: methyl 5-[5-(cyclohexanecarbonylamino)-6-oxo-heptyl]-2-methyl-1,3-dioxane-2-carboxylate CAS Name: 5-[5-[[cyclohexyl(oxo)methyl]amino]-6-oxoheptyl]-2-methyl-1,3-dioxane-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[5-(cyclohexanecarbonylamino)-6-oxoheptyl]-2-methyl-1,3-dioxane-2-carboxylate Traditional Name: 5-[5-(cyclohexanecarbonylamino)-6-keto-heptyl]-2-methyl-1,3-dioxane-2-carboxylic acid methyl ester Formula: C21H35NO6 MolecularWeight: 397.5057

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCC1COC(OC1)(C)C(=O)OC)NC(=O)C2CCCCC2

Isomeric SMILES

CC(=O)C(CCCCC1COC(OC1)(C)C(=O)OC)NC(=O)C2CCCCC2

InChI

InChI=1S/C21H35NO6/c1-15(23)18(22-19(24)17-10-5-4-6-11-17)12-8-7-9-16-13-27-21(2,28-14-16)20(25)26-3/h16-18H,4-14H2,1-3H3,(H,22,24)