ethyl 4-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-methyl-3-(4-nitro-1-pyrazolyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-methyl-3-(4-nitropyrazol-1-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H21N5O5 MolecularWeight: 339.34704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N5O5/c1-3-24-14(21)17-6-4-16(5-7-17)13(20)11(2)9-18-10-12(8-15-18)19(22)23/h8,10-11H,3-7,9H2,1-2H3