bis[(1S,2S)-2-methanoylcyclohexyl] octanedioate

Systemtic Name: bis[(1S,2S)-2-methanoylcyclohexyl] octanedioate Openeye Name: bis[(1S,2S)-2-formylcyclohexyl] octanedioate CAS Name: octanedioic acid bis[(1S,2S)-2-formylcyclohexyl] ester IUPAC Name: bis[(1S,2S)-2-formylcyclohexyl] octanedioate Traditional Name: suberic acid bis[(1S,2S)-2-formylcyclohexyl] ester Formula: C22H34O6 MolecularWeight: 394.50176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C=O)OC(=O)CCCCCCC(=O)OC2CCCCC2C=O

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C=O)OC(=O)CCCCCCC(=O)O[C@H]2CCCC[C@@H]2C=O

InChI

InChI=1S/C22H34O6/c23-15-17-9-5-7-11-19(17)27-21(25)13-3-1-2-4-14-22(26)28-20-12-8-6-10-18(20)16-24/h15-20H,1-14H2/t17-,18-,19+,20+/m1/s1