[4-(2-hexyldecoxy)phenyl] 4-oxidanylbenzenesulfinate

Systemtic Name: [4-(2-hexyldecoxy)phenyl] 4-oxidanylbenzenesulfinate Openeye Name: [4-(2-hexyldecoxy)phenyl] 4-hydroxybenzenesulfinate CAS Name: 4-hydroxybenzenesulfinic acid [4-(2-hexyldecoxy)phenyl] ester IUPAC Name: [4-(2-hexyldecoxy)phenyl] 4-hydroxybenzenesulfinate Traditional Name: 4-hydroxybenzenesulfinic acid [4-(2-hexyldecoxy)phenyl] ester Formula: C28H42O4S MolecularWeight: 474.69568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)COC1=CC=C(C=C1)OS(=O)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCC(CCCCCC)COC1=CC=C(C=C1)OS(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C28H42O4S/c1-3-5-7-9-10-12-14-24(13-11-8-6-4-2)23-31-26-17-19-27(20-18-26)32-33(30)28-21-15-25(29)16-22-28/h15-22,24,29H,3-14,23H2,1-2H3