1-[(E)-but-2-enyl]-N-butyl-3-nitro-pyrazole-4-carboxamide

Systemtic Name: 1-[(E)-but-2-enyl]-N-butyl-3-nitro-pyrazole-4-carboxamide Openeye Name: 1-[(E)-but-2-enyl]-N-butyl-3-nitro-pyrazole-4-carboxamide CAS Name: 1-[(E)-but-2-enyl]-N-butyl-3-nitro-4-pyrazolecarboxamide IUPAC Name: 1-[(E)-but-2-enyl]-N-butyl-3-nitropyrazole-4-carboxamide Traditional Name: 1-[(E)-but-2-enyl]-N-butyl-3-nitro-pyrazole-4-carboxamide Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(N=C1[N+](=O)[O-])CC=CC

Isomeric SMILES

CCCCNC(=O)C1=CN(N=C1[N+](=O)[O-])C/C=C/C

InChI

InChI=1S/C12H18N4O3/c1-3-5-7-13-12(17)10-9-15(8-6-4-2)14-11(10)16(18)19/h4,6,9H,3,5,7-8H2,1-2H3,(H,13,17)/b6-4+