3-hexadecylsulfonyl-1-methylsulfonyl-cyclohexa-1,3-diene

Systemtic Name: 3-hexadecylsulfonyl-1-methylsulfonyl-cyclohexa-1,3-diene Openeye Name: 3-hexadecylsulfonyl-1-methylsulfonyl-cyclohexa-1,3-diene CAS Name: 3-hexadecylsulfonyl-1-methylsulfonylcyclohexa-1,3-diene IUPAC Name: 3-hexadecylsulfonyl-1-methylsulfonylcyclohexa-1,3-diene Traditional Name: 3-cetylsulfonyl-1-mesyl-cyclohexa-1,3-diene Formula: C23H42O4S2 MolecularWeight: 446.70718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)C1=CCCC(=C1)S(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)C1=CCCC(=C1)S(=O)(=O)C

InChI

InChI=1S/C23H42O4S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-29(26,27)23-19-17-18-22(21-23)28(2,24)25/h19,21H,3-18,20H2,1-2H3