ethyl 4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoyl]piperazine-1-carboxylate CAS Name: 4-[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(5-methyl-3-nitropyrazol-1-yl)butanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H23N5O5 MolecularWeight: 353.37362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C(=O)OCC)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C(=O)OCC)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C15H23N5O5/c1-4-12(19-11(3)10-13(16-19)20(23)24)14(21)17-6-8-18(9-7-17)15(22)25-5-2/h10,12H,4-9H2,1-3H3