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

Systemtic Name: 1,3-benzodioxol-5-yl 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: 1,3-benzodioxol-5-yl 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid 1,3-benzodioxol-5-yl ester Formula: C17H14O4S2 MolecularWeight: 346.42066

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H14O4S2/c18-16(21-13-5-6-14-15(9-13)20-10-19-14)11-1-3-12(4-2-11)17-22-7-8-23-17/h1-6,9,17H,7-8,10H2