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diethyl 2-(2-nitro-1-thiophen-2-yl-ethyl)propanedioate

diethyl 2-(2-nitro-1-thiophen-2-yl-ethyl)propanedioate

Systemtic Name:diethyl 2-(2-nitro-1-thiophen-2-yl-ethyl)propanedioate
Openeye Name:diethyl 2-[2-nitro-1-(2-thienyl)ethyl]propanedioate
CAS Name:2-(2-nitro-1-thiophen-2-ylethyl)propanedioic acid diethyl ester
IUPAC Name:diethyl 2-(2-nitro-1-thiophen-2-ylethyl)propanedioate
Traditional Name:2-[2-nitro-1-(2-thienyl)ethyl]malonic acid diethyl ester
Formula: C13H17NO6S
MolecularWeight: 315.34218
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C[N+](=O)[O-])C1=CC=CS1)C(=O)OCC


Isomeric SMILES

CCOC(=O)C(C(C[N+](=O)[O-])C1=CC=CS1)C(=O)OCC


InChI

InChI=1S/C13H17NO6S/c1-3-19-12(15)11(13(16)20-4-2)9(8-14(17)18)10-6-5-7-21-10/h5-7,9,11H,3-4,8H2,1-2H3


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