cyclohexane; 3,4-diethylphthalate

Systemtic Name: cyclohexane; 3,4-diethylphthalate Openeye Name: cyclohexane; 3,4-diethylphthalate CAS Name: cyclohexane; 3,4-diethylphthalate IUPAC Name: cyclohexane; 3,4-diethylphthalate Traditional Name: cyclohexane; 3,4-diethylphthalate Formula: C18H24O4-2 MolecularWeight: 304.38076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC.C1CCCCC1

Isomeric SMILES

CCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC.C1CCCCC1

InChI

InChI=1S/C12H14O4.C6H12/c1-3-7-5-6-9(11(13)14)10(12(15)16)8(7)4-2;1-2-4-6-5-3-1/h5-6H,3-4H2,1-2H3,(H,13,14)(H,15,16);1-6H2/p-2