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[(E)-16-oxidanylidene-19-phenyl-nonadec-18-enyl] methanesulfonate

[(E)-16-oxidanylidene-19-phenyl-nonadec-18-enyl] methanesulfonate

Systemtic Name:[(E)-16-oxidanylidene-19-phenyl-nonadec-18-enyl] methanesulfonate
Openeye Name:[(E)-16-oxo-19-phenyl-nonadec-18-enyl] methanesulfonate
CAS Name:methanesulfonic acid [(E)-16-oxo-19-phenylnonadec-18-enyl] ester
IUPAC Name:[(E)-16-oxo-19-phenylnonadec-18-enyl] methanesulfonate
Traditional Name:methanesulfonic acid [(E)-16-keto-19-phenyl-nonadec-18-enyl] ester
Formula: C26H42O4S
MolecularWeight: 450.67428
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCCCCCCCCCCCCCC(=O)CC=CC1=CC=CC=C1


Isomeric SMILES

CS(=O)(=O)OCCCCCCCCCCCCCCCC(=O)C/C=C/C1=CC=CC=C1


InChI

InChI=1S/C26H42O4S/c1-31(28,29)30-24-17-12-10-8-6-4-2-3-5-7-9-11-16-22-26(27)23-18-21-25-19-14-13-15-20-25/h13-15,18-21H,2-12,16-17,22-24H2,1H3/b21-18+


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