N-(6-nitro-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C10H9N3O3S MolecularWeight: 251.26176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O3S/c1-2-9(14)12-10-11-7-4-3-6(13(15)16)5-8(7)17-10/h3-5H,2H2,1H3,(H,11,12,14)