4-bromanyl-2-nitro-6-[(E)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenolate

Systemtic Name: 4-bromanyl-2-nitro-6-[(E)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenolate Openeye Name: 4-bromo-2-nitro-6-[(E)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenolate CAS Name: 4-bromo-2-nitro-6-[(E)-[(1-oxo-2-thiophen-2-ylethyl)hydrazinylidene]methyl]phenolate IUPAC Name: 4-bromo-2-nitro-6-[(E)-[(2-thiophen-2-ylacetyl)hydrazinylidene]methyl]phenolate Traditional Name: 4-bromo-2-nitro-6-[(E)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenolate Formula: C13H9BrN3O4S- MolecularWeight: 383.19726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC(=O)NN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CSC(=C1)CC(=O)N/N=C/C2=CC(=CC(=C2[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C13H10BrN3O4S/c14-9-4-8(13(19)11(5-9)17(20)21)7-15-16-12(18)6-10-2-1-3-22-10/h1-5,7,19H,6H2,(H,16,18)/p-1/b15-7+