5-[5-[(4-chlorophenyl)carbonylamino]-6-oxidanyl-6-oxidanylidene-hexyl]-2-methyl-1,3-dioxane-2-carboxylic acid

Systemtic Name: 5-[5-[(4-chlorophenyl)carbonylamino]-6-oxidanyl-6-oxidanylidene-hexyl]-2-methyl-1,3-dioxane-2-carboxylic acid Openeye Name: 5-[5-[(4-chlorobenzoyl)amino]-6-hydroxy-6-oxo-hexyl]-2-methyl-1,3-dioxane-2-carboxylic acid CAS Name: 5-[5-[[(4-chlorophenyl)-oxomethyl]amino]-6-hydroxy-6-oxohexyl]-2-methyl-1,3-dioxane-2-carboxylic acid IUPAC Name: 5-[5-[(4-chlorobenzoyl)amino]-6-hydroxy-6-oxohexyl]-2-methyl-1,3-dioxane-2-carboxylic acid Traditional Name: 5-[5-[(4-chlorobenzoyl)amino]-6-hydroxy-6-keto-hexyl]-2-methyl-1,3-dioxane-2-carboxylic acid Formula: C19H24ClNO7 MolecularWeight: 413.84936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CCCCC(C(=O)O)NC(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1(OCC(CO1)CCCCC(C(=O)O)NC(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C19H24ClNO7/c1-19(18(25)26)27-10-12(11-28-19)4-2-3-5-15(17(23)24)21-16(22)13-6-8-14(20)9-7-13/h6-9,12,15H,2-5,10-11H2,1H3,(H,21,22)(H,23,24)(H,25,26)