4-[2-(1,4-dioxan-2-ylcarbonylamino)ethyl]benzoic acid

Systemtic Name: 4-[2-(1,4-dioxan-2-ylcarbonylamino)ethyl]benzoic acid Openeye Name: 4-[2-(1,4-dioxane-2-carbonylamino)ethyl]benzoic acid CAS Name: 4-[2-[[1,4-dioxan-2-yl(oxo)methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-(1,4-dioxane-2-carbonylamino)ethyl]benzoic acid Traditional Name: 4-[2-(1,4-dioxane-2-carbonylamino)ethyl]benzoic acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CO1)C(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1COC(CO1)C(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H17NO5/c16-13(12-9-19-7-8-20-12)15-6-5-10-1-3-11(4-2-10)14(17)18/h1-4,12H,5-9H2,(H,15,16)(H,17,18)