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

Systemtic Name: 2-(1,4-dioxan-2-yloxy)-2-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]propanedioic acid Openeye Name: 2-(1,4-dioxan-2-yloxy)-2-[[4-(2-quinolylmethoxy)phenyl]methyl]propanedioic acid CAS Name: 2-(1,4-dioxan-2-yloxy)-2-[[4-(2-quinolinylmethoxy)phenyl]methyl]propanedioic acid IUPAC Name: 2-(1,4-dioxan-2-yloxy)-2-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]propanedioic acid Traditional Name: 2-(1,4-dioxan-2-yloxy)-2-[4-(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=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)(C(=O)O)C(=O)O

Isomeric SMILES

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

InChI

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