2-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(1-phenylethyl)ethanamide Openeye Name: 2-(4-bromo-3-nitro-pyrazol-1-yl)-N-(1-phenylethyl)acetamide CAS Name: 2-(4-bromo-3-nitro-1-pyrazolyl)-N-(1-phenylethyl)acetamide IUPAC Name: 2-(4-bromo-3-nitropyrazol-1-yl)-N-(1-phenylethyl)acetamide Traditional Name: 2-(4-bromo-3-nitro-pyrazol-1-yl)-N-(1-phenylethyl)acetamide Formula: C13H13BrN4O3 MolecularWeight: 353.17132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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