2-(1,4-dioxan-2-yloxy)-2-[[3-(quinolin-2-ylmethoxy)phenyl]methyl]propanedioic acid

Systemtic Name: 2-(1,4-dioxan-2-yloxy)-2-[[3-(quinolin-2-ylmethoxy)phenyl]methyl]propanedioic acid Openeye Name: 2-(1,4-dioxan-2-yloxy)-2-[[3-(2-quinolylmethoxy)phenyl]methyl]propanedioic acid CAS Name: 2-(1,4-dioxan-2-yloxy)-2-[[3-(2-quinolinylmethoxy)phenyl]methyl]propanedioic acid IUPAC Name: 2-(1,4-dioxan-2-yloxy)-2-[[3-(quinolin-2-ylmethoxy)phenyl]methyl]propanedioic acid Traditional Name: 2-(1,4-dioxan-2-yloxy)-2-[3-(2-quinolylmethoxy)benzyl]malonic acid Formula: C24H23NO8 MolecularWeight: 453.44132

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CO1)OC(CC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)(C(=O)O)C(=O)O

Isomeric SMILES

C1COC(CO1)OC(CC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)(C(=O)O)C(=O)O

InChI

InChI=1S/C24H23NO8/c26-22(27)24(23(28)29,33-21-15-30-10-11-31-21)13-16-4-3-6-19(12-16)32-14-18-9-8-17-5-1-2-7-20(17)25-18/h1-9,12,21H,10-11,13-15H2,(H,26,27)(H,28,29)