3,5-bis(phenylmethoxy)-4-[(1S,2R)-2-phenylmethoxycarbonylcyclohexyl]carbonyl-benzoic acid

Systemtic Name: 3,5-bis(phenylmethoxy)-4-[(1S,2R)-2-phenylmethoxycarbonylcyclohexyl]carbonyl-benzoic acid Openeye Name: 3,5-dibenzyloxy-4-[(1S,2R)-2-benzyloxycarbonylcyclohexanecarbonyl]benzoic acid CAS Name: 4-[oxo-[(1S,2R)-2-phenylmethoxycarbonylcyclohexyl]methyl]-3,5-bis(phenylmethoxy)benzoic acid IUPAC Name: 3,5-bis(phenylmethoxy)-4-[(1S,2R)-2-phenylmethoxycarbonylcyclohexanecarbonyl]benzoic acid Traditional Name: 3,5-dibenzoxy-4-[(1S,2R)-2-carbobenzoxycyclohexanecarbonyl]benzoic acid Formula: C36H34O7 MolecularWeight: 578.65096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)C2=C(C=C(C=C2OCC3=CC=CC=C3)C(=O)O)OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)C2=C(C=C(C=C2OCC3=CC=CC=C3)C(=O)O)OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C36H34O7/c37-34(29-18-10-11-19-30(29)36(40)43-24-27-16-8-3-9-17-27)33-31(41-22-25-12-4-1-5-13-25)20-28(35(38)39)21-32(33)42-23-26-14-6-2-7-15-26/h1-9,12-17,20-21,29-30H,10-11,18-19,22-24H2,(H,38,39)/t29-,30+/m0/s1