5-(5-benzamido-6-oxidanyl-6-oxidanylidene-hexyl)-2-methyl-1,3-dioxane-2-carboxylic acid

Systemtic Name: 5-(5-benzamido-6-oxidanyl-6-oxidanylidene-hexyl)-2-methyl-1,3-dioxane-2-carboxylic acid Openeye Name: 5-(5-benzamido-6-hydroxy-6-oxo-hexyl)-2-methyl-1,3-dioxane-2-carboxylic acid CAS Name: 5-(5-benzamido-6-hydroxy-6-oxohexyl)-2-methyl-1,3-dioxane-2-carboxylic acid IUPAC Name: 5-(5-benzamido-6-hydroxy-6-oxohexyl)-2-methyl-1,3-dioxane-2-carboxylic acid Traditional Name: 5-(5-benzamido-6-hydroxy-6-keto-hexyl)-2-methyl-1,3-dioxane-2-carboxylic acid Formula: C19H25NO7 MolecularWeight: 379.4043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO7/c1-19(18(24)25)26-11-13(12-27-19)7-5-6-10-15(17(22)23)20-16(21)14-8-3-2-4-9-14/h2-4,8-9,13,15H,5-7,10-12H2,1H3,(H,20,21)(H,22,23)(H,24,25)