[2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate

Systemtic Name: [2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate Openeye Name: [2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate CAS Name: 2-propenoic acid [2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl ester IUPAC Name: [2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate Traditional Name: acrylic acid [2-(4-bromophenyl)-1,3-dithiolan-4-yl]methyl ester Formula: C13H13BrO2S2 MolecularWeight: 345.27512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCC1CSC(S1)C2=CC=C(C=C2)Br

Isomeric SMILES

C=CC(=O)OCC1CSC(S1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H13BrO2S2/c1-2-12(15)16-7-11-8-17-13(18-11)9-3-5-10(14)6-4-9/h2-6,11,13H,1,7-8H2