3-(4-bromanylpyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propanamide

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-(2-cyano-4-nitrophenyl)propanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-(2-cyano-4-nitrophenyl)propanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propionamide Formula: C13H10BrN5O3 MolecularWeight: 364.1542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrN5O3/c14-10-7-16-18(8-10)4-3-13(20)17-12-2-1-11(19(21)22)5-9(12)6-15/h1-2,5,7-8H,3-4H2,(H,17,20)