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

Systemtic Name: (4-propanoylphenyl) 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: (4-propanoylphenyl) 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid (4-propionylphenyl) ester Formula: C19H18O3S2 MolecularWeight: 358.47442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C19H18O3S2/c1-2-17(20)13-7-9-16(10-8-13)22-18(21)14-3-5-15(6-4-14)19-23-11-12-24-19/h3-10,19H,2,11-12H2,1H3