4-bromanyl-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C21H20BrN5O5 MolecularWeight: 502.318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C=C1Br)CC2=CC=C(C=C2)[N+](=O)[O-])C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1Br)CC2=CC=C(C=C2)[N+](=O)[O-])/C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H20BrN5O5/c1-13(17-9-8-16(31-2)10-19(17)32-3)23-24-21(28)20-18(22)12-26(25-20)11-14-4-6-15(7-5-14)27(29)30/h4-10,12H,11H2,1-3H3,(H,24,28)/b23-13+