methyl (2E)-2-hydroxyimino-3-(4-methylphenyl)sulfanyl-propanoate

Systemtic Name: methyl (2E)-2-hydroxyimino-3-(4-methylphenyl)sulfanyl-propanoate Openeye Name: methyl (2E)-2-hydroxyimino-3-(p-tolylsulfanyl)propanoate CAS Name: (2E)-2-hydroxyimino-3-[(4-methylphenyl)thio]propanoic acid methyl ester IUPAC Name: methyl (2E)-2-hydroxyimino-3-(4-methylphenyl)sulfanylpropanoate Traditional Name: (2E)-2-hydroximino-3-(p-tolylthio)propionic acid methyl ester Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=NO)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC/C(=N/O)/C(=O)OC

InChI

InChI=1S/C11H13NO3S/c1-8-3-5-9(6-4-8)16-7-10(12-14)11(13)15-2/h3-6,14H,7H2,1-2H3/b12-10-