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

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Formula: C19H16BrN5O3 MolecularWeight: 442.26604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C=C1)CC2=CC=C(C=C2)Br)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1)CC2=CC=C(C=C2)Br)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrN5O3/c1-13(15-4-8-17(9-5-15)25(27)28)21-22-19(26)18-10-11-24(23-18)12-14-2-6-16(20)7-3-14/h2-11H,12H2,1H3,(H,22,26)/b21-13+