N-(2-ethyl-3,4-dihydropyrazol-4-yl)-4-nitro-benzamide

Systemtic Name: N-(2-ethyl-3,4-dihydropyrazol-4-yl)-4-nitro-benzamide Openeye Name: N-(2-ethyl-3,4-dihydropyrazol-4-yl)-4-nitro-benzamide CAS Name: N-(2-ethyl-3,4-dihydropyrazol-4-yl)-4-nitrobenzamide IUPAC Name: N-(2-ethyl-3,4-dihydropyrazol-4-yl)-4-nitrobenzamide Traditional Name: N-(1-ethyl-2-pyrazolin-4-yl)-4-nitro-benzamide Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(C=N1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN1CC(C=N1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3/c1-2-15-8-10(7-13-15)14-12(17)9-3-5-11(6-4-9)16(18)19/h3-7,10H,2,8H2,1H3,(H,14,17)