[4-(5-sulfanylidene-1,2-dithiol-3-yl)phenyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: [4-(5-sulfanylidene-1,2-dithiol-3-yl)phenyl] 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: [4-(5-thioxodithiol-3-yl)phenyl] 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid [4-(5-sulfanylidene-3-dithiolyl)phenyl] ester IUPAC Name: [4-(5-sulfanylidenedithiol-3-yl)phenyl] 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid [4-(5-thioxodithiol-3-yl)phenyl] ester Formula: C19H15ClO3S3 MolecularWeight: 422.9686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC1=CC=C(C=C1)C2=CC(=S)SS2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)OC1=CC=C(C=C1)C2=CC(=S)SS2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15ClO3S3/c1-19(2,23-15-9-5-13(20)6-10-15)18(21)22-14-7-3-12(4-8-14)16-11-17(24)26-25-16/h3-11H,1-2H3