methyl (6E)-6-methylsulfanyl-5-oxidanylidene-6-(phenylhydrazinylidene)hexanoate

Systemtic Name: methyl (6E)-6-methylsulfanyl-5-oxidanylidene-6-(phenylhydrazinylidene)hexanoate Openeye Name: methyl (6E)-6-methylsulfanyl-5-oxo-6-(phenylhydrazono)hexanoate CAS Name: (6E)-6-(methylthio)-5-oxo-6-(phenylhydrazinylidene)hexanoic acid methyl ester IUPAC Name: methyl (6E)-6-methylsulfanyl-5-oxo-6-(phenylhydrazinylidene)hexanoate Traditional Name: (6E)-5-keto-6-(methylthio)-6-(phenylhydrazono)hexanoic acid methyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)C(=NNC1=CC=CC=C1)SC

Isomeric SMILES

COC(=O)CCCC(=O)/C(=N\NC1=CC=CC=C1)/SC

InChI

InChI=1S/C14H18N2O3S/c1-19-13(18)10-6-9-12(17)14(20-2)16-15-11-7-4-3-5-8-11/h3-5,7-8,15H,6,9-10H2,1-2H3/b16-14+