N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C19H20BrClN6O4 MolecularWeight: 511.7569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C)Br

InChI

InChI=1S/C19H20BrClN6O4/c1-12-18(20)13(2)26(23-12)8-3-7-22-19(28)16-6-9-25(24-16)11-31-17-5-4-14(27(29)30)10-15(17)21/h4-6,9-10H,3,7-8,11H2,1-2H3,(H,22,28)