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

Systemtic Name: 4-bromanyl-N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(E)-(2,4-dimethoxyphenyl)methyleneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(E)-(2,4-dimethoxybenzylidene)amino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C20H18BrN5O5 MolecularWeight: 488.29142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=NNC(=O)C2=NN(C=C2Br)CC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=N/NC(=O)C2=NN(C=C2Br)CC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H18BrN5O5/c1-30-16-8-5-14(18(9-16)31-2)10-22-23-20(27)19-17(21)12-25(24-19)11-13-3-6-15(7-4-13)26(28)29/h3-10,12H,11H2,1-2H3,(H,23,27)/b22-10+