2-(1,2-dioxetan-3-yloxycarbonyl)tridecanoic acid

Systemtic Name: 2-(1,2-dioxetan-3-yloxycarbonyl)tridecanoic acid Openeye Name: 2-(dioxetan-3-yloxycarbonyl)tridecanoic acid CAS Name: 2-[3-dioxetanyloxy(oxo)methyl]tridecanoic acid IUPAC Name: 2-(dioxetan-3-yloxycarbonyl)tridecanoic acid Traditional Name: 2-(dioxetan-3-yloxycarbonyl)tridecanoic acid Formula: C16H28O6 MolecularWeight: 316.38992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(=O)O)C(=O)OC1COO1

Isomeric SMILES

CCCCCCCCCCCC(C(=O)O)C(=O)OC1COO1

InChI

InChI=1S/C16H28O6/c1-2-3-4-5-6-7-8-9-10-11-13(15(17)18)16(19)21-14-12-20-22-14/h13-14H,2-12H2,1H3,(H,17,18)