ethyl 2-(5-nitrothiophen-2-yl)-2-oxidanyl-propanoate

Systemtic Name: ethyl 2-(5-nitrothiophen-2-yl)-2-oxidanyl-propanoate Openeye Name: ethyl 2-hydroxy-2-(5-nitro-2-thienyl)propanoate CAS Name: 2-hydroxy-2-(5-nitro-2-thiophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-(5-nitrothiophen-2-yl)propanoate Traditional Name: 2-hydroxy-2-(5-nitro-2-thienyl)propionic acid ethyl ester Formula: C9H11NO5S MolecularWeight: 245.25234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO5S/c1-3-15-8(11)9(2,12)6-4-5-7(16-6)10(13)14/h4-5,12H,3H2,1-2H3