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

Systemtic Name: (4-methoxycarbonylphenyl) 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: (4-methoxycarbonylphenyl) 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid (4-carbomethoxyphenyl) ester Formula: C18H16O4S2 MolecularWeight: 360.44724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O4S2/c1-21-16(19)12-6-8-15(9-7-12)22-17(20)13-2-4-14(5-3-13)18-23-10-11-24-18/h2-9,18H,10-11H2,1H3