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

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)dodecanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)dodecanamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)dodecanamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)dodecanamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)lauramide Formula: C19H27N3O3S MolecularWeight: 377.50098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18(23)21-19-20-16-13-12-15(22(24)25)14-17(16)26-19/h12-14H,2-11H2,1H3,(H,20,21,23)