N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-benzamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-benzamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-benzamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-methylbenzamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-methylbenzamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-benzamide Formula: C22H23BrN4O4 MolecularWeight: 487.34642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N(C)CC3=C(C=CC(=C3)Br)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N(C)CC3=C(C=CC(=C3)Br)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C22H23BrN4O4/c1-14-21(27(29)30)15(2)26(24-14)12-16-5-7-17(8-6-16)22(28)25(3)13-18-11-19(23)9-10-20(18)31-4/h5-11H,12-13H2,1-4H3