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

Systemtic Name: bis[(1S,2S)-2-methanoylcyclohexyl] heptanedioate Openeye Name: bis[(1S,2S)-2-formylcyclohexyl] heptanedioate CAS Name: heptanedioic acid bis[(1S,2S)-2-formylcyclohexyl] ester IUPAC Name: bis[(1S,2S)-2-formylcyclohexyl] heptanedioate Traditional Name: pimelic acid bis[(1S,2S)-2-formylcyclohexyl] ester Formula: C21H32O6 MolecularWeight: 380.47518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32O6/c22-14-16-8-4-6-10-18(16)26-20(24)12-2-1-3-13-21(25)27-19-11-7-5-9-17(19)15-23/h14-19H,1-13H2/t16-,17-,18+,19+/m1/s1