3-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-(4-nitrophenyl)propanamide Openeye Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-N-(4-nitrophenyl)propanamide CAS Name: 3-(4-bromo-3-methyl-1-pyrazolyl)-N-(4-nitrophenyl)propanamide IUPAC Name: 3-(4-bromo-3-methylpyrazol-1-yl)-N-(4-nitrophenyl)propanamide Traditional Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-N-(4-nitrophenyl)propionamide Formula: C13H13BrN4O3 MolecularWeight: 353.17132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C=C1Br)CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13BrN4O3/c1-9-12(14)8-17(16-9)7-6-13(19)15-10-2-4-11(5-3-10)18(20)21/h2-5,8H,6-7H2,1H3,(H,15,19)