6-nitro-3-piperidin-4-yl-1,2-benzothiazole

Systemtic Name: 6-nitro-3-piperidin-4-yl-1,2-benzothiazole Openeye Name: 6-nitro-3-(4-piperidyl)-1,2-benzothiazole CAS Name: 6-nitro-3-(4-piperidinyl)-1,2-benzothiazole IUPAC Name: 6-nitro-3-piperidin-4-yl-1,2-benzothiazole Traditional Name: 6-nitro-3-(4-piperidyl)-1,2-benzothiazole Formula: C12H13N3O2S MolecularWeight: 263.31552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NSC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CNCCC1C2=NSC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O2S/c16-15(17)9-1-2-10-11(7-9)18-14-12(10)8-3-5-13-6-4-8/h1-2,7-8,13H,3-6H2