methyl 2-(2-cyano-5-nitro-phenyl)sulfanylethanoate

Systemtic Name: methyl 2-(2-cyano-5-nitro-phenyl)sulfanylethanoate Openeye Name: methyl 2-(2-cyano-5-nitro-phenyl)sulfanylacetate CAS Name: 2-[(2-cyano-5-nitrophenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-cyano-5-nitrophenyl)sulfanylacetate Traditional Name: 2-[(2-cyano-5-nitro-phenyl)thio]acetic acid methyl ester Formula: C10H8N2O4S MolecularWeight: 252.24652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=CC(=C1)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)CSC1=C(C=CC(=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C10H8N2O4S/c1-16-10(13)6-17-9-4-8(12(14)15)3-2-7(9)5-11/h2-4H,6H2,1H3