2-oxidanyl-4-[12-(phenylsulfinyl)dodecoxy]benzoic acid

Systemtic Name: 2-oxidanyl-4-[12-(phenylsulfinyl)dodecoxy]benzoic acid Openeye Name: 4-[12-(benzenesulfinyl)dodecoxy]-2-hydroxy-benzoic acid CAS Name: 4-[12-(benzenesulfinyl)dodecoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[12-(benzenesulfinyl)dodecoxy]-2-hydroxybenzoic acid Traditional Name: 4-[12-(benzenesulfinyl)dodecoxy]-2-hydroxy-benzoic acid Formula: C25H34O5S MolecularWeight: 446.59946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)CCCCCCCCCCCCOC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)CCCCCCCCCCCCOC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C25H34O5S/c26-24-20-21(16-17-23(24)25(27)28)30-18-12-7-5-3-1-2-4-6-8-13-19-31(29)22-14-10-9-11-15-22/h9-11,14-17,20,26H,1-8,12-13,18-19H2,(H,27,28)