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

Systemtic Name: 3-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(2-methyl-4-nitro-phenyl)propanamide Openeye Name: 3-(4-bromo-5-methyl-pyrazol-1-yl)-N-(2-methyl-4-nitro-phenyl)propanamide CAS Name: 3-(4-bromo-5-methyl-1-pyrazolyl)-N-(2-methyl-4-nitrophenyl)propanamide IUPAC Name: 3-(4-bromo-5-methylpyrazol-1-yl)-N-(2-methyl-4-nitrophenyl)propanamide Traditional Name: 3-(4-bromo-5-methyl-pyrazol-1-yl)-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C14H15BrN4O3 MolecularWeight: 367.1979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCN2C(=C(C=N2)Br)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCN2C(=C(C=N2)Br)C

InChI

InChI=1S/C14H15BrN4O3/c1-9-7-11(19(21)22)3-4-13(9)17-14(20)5-6-18-10(2)12(15)8-16-18/h3-4,7-8H,5-6H2,1-2H3,(H,17,20)