2-cyclohexyl-3-oxidanylidene-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-cyclohexyl-3-oxidanylidene-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-cyclohexyl-3-oxo-propanoic acid CAS Name: 2-cyclohexyl-3-oxo-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-cyclohexyl-3-oxo-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-cyclohexyl-3-keto-propionic acid Formula: C22H24O4 MolecularWeight: 352.42356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(C(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H24O4/c23-21(20(22(24)25)17-9-5-2-6-10-17)18-11-13-19(14-12-18)26-15-16-7-3-1-4-8-16/h1,3-4,7-8,11-14,17,20H,2,5-6,9-10,15H2,(H,24,25)