(4-cyano-2-methoxy-phenyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoate Openeye Name: (4-cyano-2-methoxy-phenyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetic acid (4-cyano-2-methoxy-phenyl) ester Formula: C18H15NO5S MolecularWeight: 357.3804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H15NO5S/c1-21-16-8-12(10-19)2-4-15(16)24-18(20)11-25-13-3-5-14-17(9-13)23-7-6-22-14/h2-5,8-9H,6-7,11H2,1H3