10-phenoxy-2-sulfanylidene-decanoic acid

Systemtic Name: 10-phenoxy-2-sulfanylidene-decanoic acid Openeye Name: 10-phenoxy-2-thioxo-decanoic acid CAS Name: 10-phenoxy-2-sulfanylidenedecanoic acid IUPAC Name: 10-phenoxy-2-sulfanylidenedecanoic acid Traditional Name: 10-phenoxy-2-thioxo-capric acid Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3S/c17-16(18)15(20)12-8-3-1-2-4-9-13-19-14-10-6-5-7-11-14/h5-7,10-11H,1-4,8-9,12-13H2,(H,17,18)