N-(5-bromanylquinolin-8-yl)-3-(3-methyl-4-nitro-pyrazol-1-yl)propanamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3

InChI

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