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

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-nitro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-4-nitro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-4-nitro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-4-nitro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-4-nitro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Formula: C19H15BrN6O5 MolecularWeight: 487.2636

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C19H15BrN6O5/c1-12(14-4-8-16(9-5-14)25(28)29)21-22-19(27)18-17(26(30)31)11-24(23-18)10-13-2-6-15(20)7-3-13/h2-9,11H,10H2,1H3,(H,22,27)/b21-12+