3-(4-bromophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[(E)-(3-nitrophenyl)methyleneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[(E)-(3-nitrobenzylidene)amino]-1H-pyrazole-5-carboxamide Formula: C17H12BrN5O3 MolecularWeight: 414.21288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=NNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H12BrN5O3/c18-13-6-4-12(5-7-13)15-9-16(21-20-15)17(24)22-19-10-11-2-1-3-14(8-11)23(25)26/h1-10H,(H,20,21)(H,22,24)/b19-10+