1-chloranyl-4,5-bis(oxidanyl)-2-phenyl-pentane-3-thione

Systemtic Name: 1-chloranyl-4,5-bis(oxidanyl)-2-phenyl-pentane-3-thione Openeye Name: 1-chloro-4,5-dihydroxy-2-phenyl-pentane-3-thione CAS Name: 1-chloro-4,5-dihydroxy-2-phenyl-3-pentanethione IUPAC Name: 1-chloro-4,5-dihydroxy-2-phenylpentane-3-thione Traditional Name: 1-chloro-4,5-dihydroxy-2-phenyl-pentane-3-thione Formula: C11H13ClO2S MolecularWeight: 244.73772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCl)C(=S)C(CO)O

Isomeric SMILES

C1=CC=C(C=C1)C(CCl)C(=S)C(CO)O

InChI

InChI=1S/C11H13ClO2S/c12-6-9(11(15)10(14)7-13)8-4-2-1-3-5-8/h1-5,9-10,13-14H,6-7H2