(3-chlorophenyl) 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: (3-chlorophenyl) 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: (3-chlorophenyl) 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid (3-chlorophenyl) ester Formula: C16H13ClO2S2 MolecularWeight: 336.85622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)OC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H13ClO2S2/c17-13-2-1-3-14(10-13)19-15(18)11-4-6-12(7-5-11)16-20-8-9-21-16/h1-7,10,16H,8-9H2