ethyl (2R)-3-nitro-2-oxidanyl-2-thiophen-2-yl-propanoate

Systemtic Name: ethyl (2R)-3-nitro-2-oxidanyl-2-thiophen-2-yl-propanoate Openeye Name: ethyl (2R)-2-hydroxy-3-nitro-2-(2-thienyl)propanoate CAS Name: (2R)-2-hydroxy-3-nitro-2-thiophen-2-ylpropanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-hydroxy-3-nitro-2-thiophen-2-ylpropanoate Traditional Name: (2R)-2-hydroxy-3-nitro-2-(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[N+](=O)[O-])(C1=CC=CS1)O

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO5S/c1-2-15-8(11)9(12,6-10(13)14)7-4-3-5-16-7/h3-5,12H,2,6H2,1H3/t9-/m0/s1