3-methyl-5-tetradecoxycarbonyl-benzenesulfinic acid

Systemtic Name: 3-methyl-5-tetradecoxycarbonyl-benzenesulfinic acid Openeye Name: 3-methyl-5-tetradecoxycarbonyl-benzenesulfinic acid CAS Name: 3-methyl-5-[oxo(tetradecoxy)methyl]benzenesulfinic acid IUPAC Name: 3-methyl-5-tetradecoxycarbonylbenzenesulfinic acid Traditional Name: 3-methyl-5-myristyloxycarbonyl-benzenesulfinic acid Formula: C22H36O4S MolecularWeight: 396.58384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)S(=O)O)C

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)S(=O)O)C

InChI

InChI=1S/C22H36O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-26-22(23)20-16-19(2)17-21(18-20)27(24)25/h16-18H,3-15H2,1-2H3,(H,24,25)