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

Systemtic Name: 2-chloranyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C10H8ClN3O3S MolecularWeight: 285.70682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8ClN3O3S/c1-5(11)9(15)13-10-12-7-3-2-6(14(16)17)4-8(7)18-10/h2-5H,1H3,(H,12,13,15)