3-[(4-tert-butylphenyl)methyl]-4-ethoxy-3-ethoxycarbonyl-4-oxidanylidene-butanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C(C)(C)C)(CC(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C(C)(C)C)(CC(=O)O)C(=O)OCC

InChI

InChI=1S/C20H28O6/c1-6-25-17(23)20(13-16(21)22,18(24)26-7-2)12-14-8-10-15(11-9-14)19(3,4)5/h8-11H,6-7,12-13H2,1-5H3,(H,21,22)