N-(3-bromophenyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(3-bromophenyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(3-bromophenyl)-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(3-bromophenyl)-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(3-bromophenyl)-1-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C12H11BrN4O3 MolecularWeight: 339.14474

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC(=CC=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC(=CC=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H11BrN4O3/c1-2-16-7-10(17(19)20)11(15-16)12(18)14-9-5-3-4-8(13)6-9/h3-7H,2H2,1H3,(H,14,18)