4-[6-(2-methoxyphenyl)hexyl]heptane-3,5-dione

Systemtic Name: 4-[6-(2-methoxyphenyl)hexyl]heptane-3,5-dione Openeye Name: 4-[6-(2-methoxyphenyl)hexyl]heptane-3,5-dione CAS Name: 4-[6-(2-methoxyphenyl)hexyl]heptane-3,5-dione IUPAC Name: 4-[6-(2-methoxyphenyl)hexyl]heptane-3,5-dione Traditional Name: 4-[6-(2-methoxyphenyl)hexyl]heptane-3,5-dione Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCC1=CC=CC=C1OC)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCC1=CC=CC=C1OC)C(=O)CC

InChI

InChI=1S/C20H30O3/c1-4-18(21)17(19(22)5-2)14-9-7-6-8-12-16-13-10-11-15-20(16)23-3/h10-11,13,15,17H,4-9,12,14H2,1-3H3