1-(4-octoxyphenyl)-2-phenyl-ethane-1,2-dione chloride

Systemtic Name: 1-(4-octoxyphenyl)-2-phenyl-ethane-1,2-dione chloride Openeye Name: 1-(4-octoxyphenyl)-2-phenyl-ethane-1,2-dione chloride CAS Name: 1-(4-octoxyphenyl)-2-phenylethane-1,2-dione chloride IUPAC Name: 1-(4-octoxyphenyl)-2-phenylethane-1,2-dione chloride Traditional Name: 1-(4-octoxyphenyl)-2-phenyl-ethane-1,2-dione chloride Formula: C22H26ClO3- MolecularWeight: 373.89304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C22H26O3.ClH/c1-2-3-4-5-6-10-17-25-20-15-13-19(14-16-20)22(24)21(23)18-11-8-7-9-12-18;/h7-9,11-16H,2-6,10,17H2,1H3;1H/p-1