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

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)-2-methyl-propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)-2-methyl-propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(3-methoxy-5-nitrophenyl)-2-methylpropanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(3-methoxy-5-nitrophenyl)-2-methylpropanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)-2-methyl-propionamide Formula: C16H19BrN4O4 MolecularWeight: 411.25046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CC(=CC(=C2)OC)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CC(=CC(=C2)OC)[N+](=O)[O-])C)Br

InChI

InChI=1S/C16H19BrN4O4/c1-9(8-20-11(3)15(17)10(2)19-20)16(22)18-12-5-13(21(23)24)7-14(6-12)25-4/h5-7,9H,8H2,1-4H3,(H,18,22)