ethyl 2-(2,5-dimethoxy-4-nitro-phenyl)sulfanylethanoate

Systemtic Name: ethyl 2-(2,5-dimethoxy-4-nitro-phenyl)sulfanylethanoate Openeye Name: ethyl 2-(2,5-dimethoxy-4-nitro-phenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethoxy-4-nitrophenyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(2,5-dimethoxy-4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethoxy-4-nitro-phenyl)thio]acetic acid ethyl ester Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C(C(=C1)OC)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)CSC1=C(C=C(C(=C1)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C12H15NO6S/c1-4-19-12(14)7-20-11-6-9(17-2)8(13(15)16)5-10(11)18-3/h5-6H,4,7H2,1-3H3