hentetracontyl methanesulfonate

Systemtic Name: hentetracontyl methanesulfonate Openeye Name: hentetracontyl methanesulfonate CAS Name: methanesulfonic acid hentetracontyl ester IUPAC Name: hentetracontyl methanesulfonate Traditional Name: methanesulfonic acid hentetracontyl ester Formula: C42H86O3S MolecularWeight: 671.19544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)C

InChI

InChI=1S/C42H86O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-45-46(2,43)44/h3-42H2,1-2H3