ethyl 1-(4-nitro-2,1,3-benzothiadiazol-5-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-nitro-2,1,3-benzothiadiazol-5-yl)piperidine-4-carboxylate Openeye Name: ethyl 1-(4-nitro-2,1,3-benzothiadiazol-5-yl)piperidine-4-carboxylate CAS Name: 1-(4-nitro-2,1,3-benzothiadiazol-5-yl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-nitro-2,1,3-benzothiadiazol-5-yl)piperidine-4-carboxylate Traditional Name: 1-(4-nitropiazthiol-5-yl)isonipecotic acid ethyl ester Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C3=NSN=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C3=NSN=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O4S/c1-2-22-14(19)9-5-7-17(8-6-9)11-4-3-10-12(16-23-15-10)13(11)18(20)21/h3-4,9H,2,5-8H2,1H3