1-(4-methoxyphenyl)heptane-1,3-dione

Systemtic Name: 1-(4-methoxyphenyl)heptane-1,3-dione Openeye Name: 1-(4-methoxyphenyl)heptane-1,3-dione CAS Name: 1-(4-methoxyphenyl)heptane-1,3-dione IUPAC Name: 1-(4-methoxyphenyl)heptane-1,3-dione Traditional Name: 1-(4-methoxyphenyl)heptane-1,3-dione Formula: C14H18O3 MolecularWeight: 234.29092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CC(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CCCCC(=O)CC(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C14H18O3/c1-3-4-5-12(15)10-14(16)11-6-8-13(17-2)9-7-11/h6-9H,3-5,10H2,1-2H3