(2,5-dimethoxyphenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: (2,5-dimethoxyphenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid (2,5-dimethoxybenzyl) ester Formula: C19H20O4S2 MolecularWeight: 376.4897

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C19H20O4S2/c1-21-16-7-8-17(22-2)15(11-16)12-23-18(20)13-3-5-14(6-4-13)19-24-9-10-25-19/h3-8,11,19H,9-10,12H2,1-2H3