N-[(4-chlorophenyl)methyl]-2-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-2-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-2-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C13H13ClN4O3 MolecularWeight: 308.72032

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H13ClN4O3/c1-2-17-12(11(8-16-17)18(20)21)13(19)15-7-9-3-5-10(14)6-4-9/h3-6,8H,2,7H2,1H3,(H,15,19)