1-methyl-2-(5-methyl-2-phenylmethoxy-phenyl)-3-oxidanylidene-cyclopentane-1-carboxylic acid

Systemtic Name: 1-methyl-2-(5-methyl-2-phenylmethoxy-phenyl)-3-oxidanylidene-cyclopentane-1-carboxylic acid Openeye Name: 2-(2-benzyloxy-5-methyl-phenyl)-1-methyl-3-oxo-cyclopentanecarboxylic acid CAS Name: 1-methyl-2-(5-methyl-2-phenylmethoxyphenyl)-3-oxo-1-cyclopentanecarboxylic acid IUPAC Name: 1-methyl-2-(5-methyl-2-phenylmethoxyphenyl)-3-oxocyclopentane-1-carboxylic acid Traditional Name: 2-(2-benzoxy-5-methyl-phenyl)-3-keto-1-methyl-cyclopentanecarboxylic acid Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3C(=O)CCC3(C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3C(=O)CCC3(C)C(=O)O

InChI

InChI=1S/C21H22O4/c1-14-8-9-18(25-13-15-6-4-3-5-7-15)16(12-14)19-17(22)10-11-21(19,2)20(23)24/h3-9,12,19H,10-11,13H2,1-2H3,(H,23,24)