[4-(1,3-dithiolan-2-yl)phenyl] 2-bromanylbenzoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-bromanylbenzoate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C16H13BrO2S2 MolecularWeight: 381.30722

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C16H13BrO2S2/c17-14-4-2-1-3-13(14)15(18)19-12-7-5-11(6-8-12)16-20-9-10-21-16/h1-8,16H,9-10H2