4-bromanyl-N-[(E)-(4-fluorophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(E)-(4-fluorophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(E)-(4-fluorophenyl)methyleneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(E)-(4-fluorophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(E)-(4-fluorophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(E)-(4-fluorobenzylidene)amino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C18H13BrFN5O3 MolecularWeight: 446.229923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=C(C(=N2)C(=O)NN=CC3=CC=C(C=C3)F)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C=C(C(=N2)C(=O)N/N=C/C3=CC=C(C=C3)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H13BrFN5O3/c19-16-11-24(10-13-3-7-15(8-4-13)25(27)28)23-17(16)18(26)22-21-9-12-1-5-14(20)6-2-12/h1-9,11H,10H2,(H,22,26)/b21-9+