3-methylsulfonyl-1-tetradecylsulfonyl-cyclohexa-1,3-diene

Systemtic Name: 3-methylsulfonyl-1-tetradecylsulfonyl-cyclohexa-1,3-diene Openeye Name: 3-methylsulfonyl-1-tetradecylsulfonyl-cyclohexa-1,3-diene CAS Name: 3-methylsulfonyl-1-tetradecylsulfonylcyclohexa-1,3-diene IUPAC Name: 3-methylsulfonyl-1-tetradecylsulfonylcyclohexa-1,3-diene Traditional Name: 3-mesyl-1-myristylsulfonyl-cyclohexa-1,3-diene Formula: C21H38O4S2 MolecularWeight: 418.65402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCS(=O)(=O)C1=CC(=CCC1)S(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCS(=O)(=O)C1=CC(=CCC1)S(=O)(=O)C

InChI

InChI=1S/C21H38O4S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-27(24,25)21-17-15-16-20(19-21)26(2,22)23/h16,19H,3-15,17-18H2,1-2H3