2-(6-methoxy-6-pentyl-1,2-dioxan-3-yl)ethanoic acid

Systemtic Name: 2-(6-methoxy-6-pentyl-1,2-dioxan-3-yl)ethanoic acid Openeye Name: 2-(6-methoxy-6-pentyl-dioxan-3-yl)acetic acid CAS Name: 2-(6-methoxy-6-pentyl-3-dioxanyl)acetic acid IUPAC Name: 2-(6-methoxy-6-pentyldioxan-3-yl)acetic acid Traditional Name: 2-(6-amyl-6-methoxy-dioxan-3-yl)acetic acid Formula: C12H22O5 MolecularWeight: 246.30008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCC(OO1)CC(=O)O)OC

Isomeric SMILES

CCCCCC1(CCC(OO1)CC(=O)O)OC

InChI

InChI=1S/C12H22O5/c1-3-4-5-7-12(15-2)8-6-10(16-17-12)9-11(13)14/h10H,3-9H2,1-2H3,(H,13,14)