methyl 3-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]benzoate

Systemtic Name: methyl 3-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]benzoate Openeye Name: methyl 3-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]benzoate CAS Name: 3-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]benzoate Traditional Name: 3-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]benzoic acid methyl ester Formula: C18H18O3S2 MolecularWeight: 346.46372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C18H18O3S2/c1-20-17(19)15-4-2-3-13(11-15)12-21-16-7-5-14(6-8-16)18-22-9-10-23-18/h2-8,11,18H,9-10,12H2,1H3