(E)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(3-nitrophenyl)acrylamide Formula: C19H12BrN5O3 MolecularWeight: 438.23428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)/C(=C/C2=C(NN=C2)C3=CC=C(C=C3)Br)/C#N

InChI

InChI=1S/C19H12BrN5O3/c20-15-6-4-12(5-7-15)18-14(11-22-24-18)8-13(10-21)19(26)23-16-2-1-3-17(9-16)25(27)28/h1-9,11H,(H,22,24)(H,23,26)/b13-8+