1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-(2-bromo-4,5-dimethoxy-benzyl)-3,5-dimethyl-4-nitro-pyrazole Formula: C14H16BrN3O4 MolecularWeight: 370.19854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=C(C=C2Br)OC)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=C(C=C2Br)OC)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C14H16BrN3O4/c1-8-14(18(19)20)9(2)17(16-8)7-10-5-12(21-3)13(22-4)6-11(10)15/h5-6H,7H2,1-4H3