N-[(4-chlorophenyl)methyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-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)C(=O)NCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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