[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 5-nitrothiophene-2-carboxylate Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [(2S)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [(1S)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C8H8N2O5S MolecularWeight: 244.22452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC=C(S1)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N)OC(=O)C1=CC=C(S1)[N+](=O)[O-]

InChI

InChI=1S/C8H8N2O5S/c1-4(7(9)11)15-8(12)5-2-3-6(16-5)10(13)14/h2-4H,1H3,(H2,9,11)/t4-/m0/s1