(1R,2S)-2-[1-(3,5-dimethoxyphenyl)-2-oxidanylidene-2-phenyl-ethoxy]carbonylcyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[1-(3,5-dimethoxyphenyl)-2-oxidanylidene-2-phenyl-ethoxy]carbonylcyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenyl-ethoxy]carbonylcyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethoxy]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethoxy]carbonylcyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[1-(3,5-dimethoxyphenyl)-2-keto-2-phenyl-ethoxy]carbonylcyclohexanecarboxylic acid Formula: C24H26O7 MolecularWeight: 426.45904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3CCCCC3C(=O)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(C(=O)C2=CC=CC=C2)OC(=O)[C@H]3CCCC[C@H]3C(=O)O)OC

InChI

InChI=1S/C24H26O7/c1-29-17-12-16(13-18(14-17)30-2)22(21(25)15-8-4-3-5-9-15)31-24(28)20-11-7-6-10-19(20)23(26)27/h3-5,8-9,12-14,19-20,22H,6-7,10-11H2,1-2H3,(H,26,27)/t19-,20+,22?/m1/s1