N-(2-diethylaminoethyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(2-diethylaminoethyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(2-diethylaminoethyl)-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(2-diethylaminoethyl)-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(2-diethylaminoethyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C12H21N5O3 MolecularWeight: 283.32684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCCN(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCCN(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C12H21N5O3/c1-4-15(5-2)8-7-13-12(18)11-10(17(19)20)9-16(6-3)14-11/h9H,4-8H2,1-3H3,(H,13,18)