(2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-nitrobenzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-nitrobenzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C13H9NO5S MolecularWeight: 291.27926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H9NO5S/c15-11(12-2-1-7-20-12)8-19-13(16)9-3-5-10(6-4-9)14(17)18/h1-7H,8H2