ethyl 2-(7-nitro-1-benzothiophen-2-yl)-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-(7-nitro-1-benzothiophen-2-yl)-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-(7-nitrobenzothiophen-2-yl)-2-oxo-acetate CAS Name: 2-(7-nitro-1-benzothiophen-2-yl)-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-(7-nitro-1-benzothiophen-2-yl)-2-oxoacetate Traditional Name: 2-keto-2-(7-nitrobenzothiophen-2-yl)acetic acid ethyl ester Formula: C12H9NO5S MolecularWeight: 279.26856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=CC2=C(S1)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=O)C1=CC2=C(S1)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO5S/c1-2-18-12(15)10(14)9-6-7-4-3-5-8(13(16)17)11(7)19-9/h3-6H,2H2,1H3