(3E)-N-(3-bromophenyl)-3-[2-(2,4-dinitrophenyl)ethanoylhydrazinylidene]butanamide

Systemtic Name: (3E)-N-(3-bromophenyl)-3-[2-(2,4-dinitrophenyl)ethanoylhydrazinylidene]butanamide Openeye Name: (3E)-N-(3-bromophenyl)-3-[[2-(2,4-dinitrophenyl)acetyl]hydrazono]butanamide CAS Name: (3E)-N-(3-bromophenyl)-3-[[2-(2,4-dinitrophenyl)-1-oxoethyl]hydrazinylidene]butanamide IUPAC Name: (3E)-N-(3-bromophenyl)-3-[[2-(2,4-dinitrophenyl)acetyl]hydrazinylidene]butanamide Traditional Name: (3E)-N-(3-bromophenyl)-3-[[2-(2,4-dinitrophenyl)acetyl]hydrazono]butyramide Formula: C18H16BrN5O6 MolecularWeight: 478.25354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CC(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

C/C(=N\NC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CC(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H16BrN5O6/c1-11(7-17(25)20-14-4-2-3-13(19)9-14)21-22-18(26)8-12-5-6-15(23(27)28)10-16(12)24(29)30/h2-6,9-10H,7-8H2,1H3,(H,20,25)(H,22,26)/b21-11+