4-chloranyl-N-(4-ethoxy-2-nitro-phenyl)-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-(4-ethoxy-2-nitro-phenyl)-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-(4-ethoxy-2-nitro-phenyl)-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-(4-ethoxy-2-nitrophenyl)-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-(4-ethoxy-2-nitrophenyl)-1-ethylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-(4-ethoxy-2-nitro-phenyl)-1-ethyl-pyrazole-3-carboxamide Formula: C14H15ClN4O4 MolecularWeight: 338.7463

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=C(C=C(C=C2)OCC)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=C(C=C(C=C2)OCC)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN4O4/c1-3-18-8-10(15)13(17-18)14(20)16-11-6-5-9(23-4-2)7-12(11)19(21)22/h5-8H,3-4H2,1-2H3,(H,16,20)