phenacyl 3-[2,5-bis(chloranyl)phenyl]sulfanylpropanoate

Systemtic Name: phenacyl 3-[2,5-bis(chloranyl)phenyl]sulfanylpropanoate Openeye Name: phenacyl 3-(2,5-dichlorophenyl)sulfanylpropanoate CAS Name: 3-[(2,5-dichlorophenyl)thio]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-(2,5-dichlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2,5-dichlorophenyl)thio]propionic acid phenacyl ester Formula: C17H14Cl2O3S MolecularWeight: 369.26226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)CCSC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)CCSC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C17H14Cl2O3S/c18-13-6-7-14(19)16(10-13)23-9-8-17(21)22-11-15(20)12-4-2-1-3-5-12/h1-7,10H,8-9,11H2