2-[3-[2,6-bis(chloranyl)-4-oxidanyl-phenoxy]propyl]-3-sulfanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 2-[3-[2,6-bis(chloranyl)-4-oxidanyl-phenoxy]propyl]-3-sulfanyl-cyclohexa-2,5-dien-1-one Openeye Name: 2-[3-(2,6-dichloro-4-hydroxy-phenoxy)propyl]-3-sulfanyl-cyclohexa-2,5-dien-1-one CAS Name: 2-[3-(2,6-dichloro-4-hydroxyphenoxy)propyl]-3-mercapto-1-cyclohexa-2,5-dienone IUPAC Name: 2-[3-(2,6-dichloro-4-hydroxyphenoxy)propyl]-3-sulfanylcyclohexa-2,5-dien-1-one Traditional Name: 2-[3-(2,6-dichloro-4-hydroxy-phenoxy)propyl]-3-mercapto-cyclohexa-2,5-dien-1-one Formula: C15H14Cl2O3S MolecularWeight: 345.24086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=O)C(=C1S)CCCOC2=C(C=C(C=C2Cl)O)Cl

Isomeric SMILES

C1C=CC(=O)C(=C1S)CCCOC2=C(C=C(C=C2Cl)O)Cl

InChI

InChI=1S/C15H14Cl2O3S/c16-11-7-9(18)8-12(17)15(11)20-6-2-3-10-13(19)4-1-5-14(10)21/h1,4,7-8,18,21H,2-3,5-6H2