2-phenoxy-11-sulfanylidene-undecanoic acid

Systemtic Name: 2-phenoxy-11-sulfanylidene-undecanoic acid Openeye Name: 2-phenoxy-11-thioxo-undecanoic acid CAS Name: 2-phenoxy-11-sulfanylideneundecanoic acid IUPAC Name: 2-phenoxy-11-sulfanylideneundecanoic acid Traditional Name: 2-phenoxy-11-thioxo-undecanoic acid Formula: C17H24O3S MolecularWeight: 308.43566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CCCCCCCCC=S)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(CCCCCCCCC=S)C(=O)O

InChI

InChI=1S/C17H24O3S/c18-17(19)16(20-15-11-7-6-8-12-15)13-9-4-2-1-3-5-10-14-21/h6-8,11-12,14,16H,1-5,9-10,13H2,(H,18,19)