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

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 3-iodanylbenzoate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C16H13IO2S2 MolecularWeight: 428.30769

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13IO2S2/c17-13-3-1-2-12(10-13)15(18)19-14-6-4-11(5-7-14)16-20-8-9-21-16/h1-7,10,16H,8-9H2