[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 5-nitrothiophene-2-carboxylate Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [(2R)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [(1R)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C14H12N2O5S MolecularWeight: 320.32048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5S/c1-9(13(17)15-10-5-3-2-4-6-10)21-14(18)11-7-8-12(22-11)16(19)20/h2-9H,1H3,(H,15,17)/t9-/m1/s1