ethyl 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperidine-3-carboxylate Openeye Name: ethyl 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperidine-3-carboxylate CAS Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methyl-5-nitro-1H-imidazol-4-yl)piperidine-3-carboxylate Traditional Name: 1-(2-methyl-5-nitro-1H-imidazol-4-yl)nipecotic acid ethyl ester Formula: C12H18N4O4 MolecularWeight: 282.29572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(NC(=N2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(NC(=N2)C)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O4/c1-3-20-12(17)9-5-4-6-15(7-9)10-11(16(18)19)14-8(2)13-10/h9H,3-7H2,1-2H3,(H,13,14)