2-[[2-[(4-bromophenyl)amino]butanoylhydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[2-[(4-bromophenyl)amino]butanoylhydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[[2-(4-bromoanilino)butanoylhydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[[[2-(4-bromoanilino)-1-oxobutyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[[2-(4-bromoanilino)butanoylhydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[[2-(4-bromoanilino)butanoylhydrazono]methyl]-4-nitro-phenolate Formula: C17H16BrN4O4- MolecularWeight: 420.23734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN4O4/c1-2-15(20-13-5-3-12(18)4-6-13)17(24)21-19-10-11-9-14(22(25)26)7-8-16(11)23/h3-10,15,20,23H,2H2,1H3,(H,21,24)/p-1