2,3-dibutyl-4-oxidanyl-benzenecarbothioic S-acid

Systemtic Name: 2,3-dibutyl-4-oxidanyl-benzenecarbothioic S-acid Openeye Name: 2,3-dibutyl-4-hydroxy-benzenecarbothioic S-acid CAS Name: 2,3-dibutyl-4-hydroxybenzenecarbothioic S-acid IUPAC Name: 2,3-dibutyl-4-hydroxybenzenecarbothioic S-acid Traditional Name: 2,3-dibutyl-4-hydroxy-thiobenzoic acid Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1CCCC)O)C(=O)S

Isomeric SMILES

CCCCC1=C(C=CC(=C1CCCC)O)C(=O)S

InChI

InChI=1S/C15H22O2S/c1-3-5-7-11-12(8-6-4-2)14(16)10-9-13(11)15(17)18/h9-10,16H,3-8H2,1-2H3,(H,17,18)