1-(2-chloranyl-5-sulfanyl-phenyl)-2-[ethoxy(oxidanyl)methylidene]pentan-1-one

Systemtic Name: 1-(2-chloranyl-5-sulfanyl-phenyl)-2-[ethoxy(oxidanyl)methylidene]pentan-1-one Openeye Name: 1-(2-chloro-5-sulfanyl-phenyl)-2-[ethoxy(hydroxy)methylene]pentan-1-one CAS Name: 1-(2-chloro-5-mercaptophenyl)-2-[ethoxy(hydroxy)methylidene]-1-pentanone IUPAC Name: 1-(2-chloro-5-sulfanylphenyl)-2-[ethoxy(hydroxy)methylidene]pentan-1-one Traditional Name: 1-(2-chloro-5-mercapto-phenyl)-3-ethoxy-3-hydroxy-2-propyl-prop-2-en-1-one Formula: C14H17ClO3S MolecularWeight: 300.80098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(O)OCC)C(=O)C1=C(C=CC(=C1)S)Cl

Isomeric SMILES

CCCC(=C(O)OCC)C(=O)C1=C(C=CC(=C1)S)Cl

InChI

InChI=1S/C14H17ClO3S/c1-3-5-10(14(17)18-4-2)13(16)11-8-9(19)6-7-12(11)15/h6-8,17,19H,3-5H2,1-2H3