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

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)-2-methyl-propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)-2-methyl-propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(4-ethoxy-2-nitrophenyl)-2-methylpropanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(4-ethoxy-2-nitrophenyl)-2-methylpropanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)-2-methyl-propionamide Formula: C17H21BrN4O4 MolecularWeight: 425.27704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C(C)CN2C(=C(C(=N2)C)Br)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C(C)CN2C(=C(C(=N2)C)Br)C)[N+](=O)[O-]

InChI

InChI=1S/C17H21BrN4O4/c1-5-26-13-6-7-14(15(8-13)22(24)25)19-17(23)10(2)9-21-12(4)16(18)11(3)20-21/h6-8,10H,5,9H2,1-4H3,(H,19,23)