2-(3-methylhexanoyloxy)-4-(oxan-2-yloxy)benzoic acid

Systemtic Name: 2-(3-methylhexanoyloxy)-4-(oxan-2-yloxy)benzoic acid Openeye Name: 2-(3-methylhexanoyloxy)-4-tetrahydropyran-2-yloxy-benzoic acid CAS Name: 2-(3-methyl-1-oxohexoxy)-4-(2-oxanyloxy)benzoic acid IUPAC Name: 2-(3-methylhexanoyloxy)-4-(oxan-2-yloxy)benzoic acid Traditional Name: 2-(3-methylhexanoyloxy)-4-tetrahydropyran-2-yloxy-benzoic acid Formula: C19H26O6 MolecularWeight: 350.40614

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(=O)OC1=C(C=CC(=C1)OC2CCCCO2)C(=O)O

Isomeric SMILES

CCCC(C)CC(=O)OC1=C(C=CC(=C1)OC2CCCCO2)C(=O)O

InChI

InChI=1S/C19H26O6/c1-3-6-13(2)11-17(20)25-16-12-14(8-9-15(16)19(21)22)24-18-7-4-5-10-23-18/h8-9,12-13,18H,3-7,10-11H2,1-2H3,(H,21,22)