2-phenoxathiin-2-ylbutanoic acid

Systemtic Name: 2-phenoxathiin-2-ylbutanoic acid Openeye Name: 2-phenoxathiin-2-ylbutanoic acid CAS Name: 2-(2-phenoxathiinyl)butanoic acid IUPAC Name: 2-phenoxathiin-2-ylbutanoic acid Traditional Name: 2-phenoxathiin-2-ylbutyric acid Formula: C16H14O3S MolecularWeight: 286.34556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

CCC(C1=CC2=C(C=C1)OC3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C16H14O3S/c1-2-11(16(17)18)10-7-8-13-15(9-10)20-14-6-4-3-5-12(14)19-13/h3-9,11H,2H2,1H3,(H,17,18)