2-[5-(3-ethoxyphenyl)-2-oxidanylidene-5-propyl-cyclohexyl]propanoic acid

Systemtic Name: 2-[5-(3-ethoxyphenyl)-2-oxidanylidene-5-propyl-cyclohexyl]propanoic acid Openeye Name: 2-[5-(3-ethoxyphenyl)-2-oxo-5-propyl-cyclohexyl]propanoic acid CAS Name: 2-[5-(3-ethoxyphenyl)-2-oxo-5-propylcyclohexyl]propanoic acid IUPAC Name: 2-[5-(3-ethoxyphenyl)-2-oxo-5-propylcyclohexyl]propanoic acid Traditional Name: 2-(2-keto-5-m-phenetyl-5-propyl-cyclohexyl)propionic acid Formula: C20H28O4 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(=O)C(C1)C(C)C(=O)O)C2=CC(=CC=C2)OCC

Isomeric SMILES

CCCC1(CCC(=O)C(C1)C(C)C(=O)O)C2=CC(=CC=C2)OCC

InChI

InChI=1S/C20H28O4/c1-4-10-20(15-7-6-8-16(12-15)24-5-2)11-9-18(21)17(13-20)14(3)19(22)23/h6-8,12,14,17H,4-5,9-11,13H2,1-3H3,(H,22,23)