3-[(3,4-diethylphenyl)methyl]-4-ethoxy-3-ethoxycarbonyl-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[(3,4-diethylphenyl)methyl]-4-ethoxy-3-ethoxycarbonyl-4-oxidanylidene-butanoic acid Openeye Name: 3-[(3,4-diethylphenyl)methyl]-4-ethoxy-3-ethoxycarbonyl-4-oxo-butanoic acid CAS Name: 3-[(3,4-diethylphenyl)methyl]-4-ethoxy-3-ethoxycarbonyl-4-oxobutanoic acid IUPAC Name: 3-[(3,4-diethylphenyl)methyl]-4-ethoxy-3-ethoxycarbonyl-4-oxobutanoic acid Traditional Name: 3-carbethoxy-3-(3,4-diethylbenzyl)-4-ethoxy-4-keto-butyric acid Formula: C20H28O6 MolecularWeight: 364.43272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)CC(CC(=O)O)(C(=O)OCC)C(=O)OCC)CC

Isomeric SMILES

CCC1=C(C=C(C=C1)CC(CC(=O)O)(C(=O)OCC)C(=O)OCC)CC

InChI

InChI=1S/C20H28O6/c1-5-15-10-9-14(11-16(15)6-2)12-20(13-17(21)22,18(23)25-7-3)19(24)26-8-4/h9-11H,5-8,12-13H2,1-4H3,(H,21,22)