N-(5-bromanylquinolin-8-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(5-bromo-8-quinolyl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-(5-bromo-8-quinolinyl)-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(5-bromoquinolin-8-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(5-bromo-8-quinolyl)-2-methyl-3-(4-nitropyrazol-1-yl)propionamide Formula: C16H14BrN5O3 MolecularWeight: 404.21806

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3

InChI

InChI=1S/C16H14BrN5O3/c1-10(8-21-9-11(7-19-21)22(24)25)16(23)20-14-5-4-13(17)12-3-2-6-18-15(12)14/h2-7,9-10H,8H2,1H3,(H,20,23)