4-bromanyl-1-(2,4-dinitrophenyl)-3-methyl-5-phenyl-pyrazole

Systemtic Name: 4-bromanyl-1-(2,4-dinitrophenyl)-3-methyl-5-phenyl-pyrazole Openeye Name: 4-bromo-1-(2,4-dinitrophenyl)-3-methyl-5-phenyl-pyrazole CAS Name: 4-bromo-1-(2,4-dinitrophenyl)-3-methyl-5-phenylpyrazole IUPAC Name: 4-bromo-1-(2,4-dinitrophenyl)-3-methyl-5-phenylpyrazole Traditional Name: 4-bromo-1-(2,4-dinitrophenyl)-3-methyl-5-phenyl-pyrazole Formula: C16H11BrN4O4 MolecularWeight: 403.18694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=C1Br)C2=CC=CC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11BrN4O4/c1-10-15(17)16(11-5-3-2-4-6-11)19(18-10)13-8-7-12(20(22)23)9-14(13)21(24)25/h2-9H,1H3