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

Systemtic Name: N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-(3-bromophenyl)methyleneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-(3-bromobenzylidene)amino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C18H14BrN5O3 MolecularWeight: 428.23946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C=NNC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)/C=N/NC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14BrN5O3/c19-15-3-1-2-14(10-15)11-20-21-18(25)17-8-9-23(22-17)12-13-4-6-16(7-5-13)24(26)27/h1-11H,12H2,(H,21,25)/b20-11+