N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C21H16BrClN6O4 MolecularWeight: 531.74654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C(=N2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-])Br)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C(=N2)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-])Br)Cl

InChI

InChI=1S/C21H16BrClN6O4/c22-15-12-28(11-14-5-1-2-6-16(14)23)26-20(15)24-21(30)17-9-10-27(25-17)13-33-19-8-4-3-7-18(19)29(31)32/h1-10,12H,11,13H2,(H,24,26,30)