1-[4-(4-octoxyphenyl)phenyl]heptane-1,3-dione

Systemtic Name: 1-[4-(4-octoxyphenyl)phenyl]heptane-1,3-dione Openeye Name: 1-[4-(4-octoxyphenyl)phenyl]heptane-1,3-dione CAS Name: 1-[4-(4-octoxyphenyl)phenyl]heptane-1,3-dione IUPAC Name: 1-[4-(4-octoxyphenyl)phenyl]heptane-1,3-dione Traditional Name: 1-[4-(4-octoxyphenyl)phenyl]heptane-1,3-dione Formula: C27H36O3 MolecularWeight: 408.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CC(=O)CCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CC(=O)CCCC

InChI

InChI=1S/C27H36O3/c1-3-5-7-8-9-10-20-30-26-18-16-23(17-19-26)22-12-14-24(15-13-22)27(29)21-25(28)11-6-4-2/h12-19H,3-11,20-21H2,1-2H3