O-methyl 2-(5-nitropyridin-2-yl)ethanethioate

Systemtic Name: O-methyl 2-(5-nitropyridin-2-yl)ethanethioate Openeye Name: O-methyl 2-(5-nitro-2-pyridyl)ethanethioate CAS Name: 2-(5-nitro-2-pyridinyl)ethanethioic acid O-methyl ester IUPAC Name: O-methyl 2-(5-nitropyridin-2-yl)ethanethioate Traditional Name: 2-(5-nitro-2-pyridyl)ethanethioic acid O-methyl ester Formula: C8H8N2O3S MolecularWeight: 212.22572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)CC1=NC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=S)CC1=NC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H8N2O3S/c1-13-8(14)4-6-2-3-7(5-9-6)10(11)12/h2-3,5H,4H2,1H3