4-bromanyl-2-[(Z)-[2-(3,4-dimethylphenoxy)ethanoylhydrazinylidene]methyl]-6-nitro-phenolate

Systemtic Name: 4-bromanyl-2-[(Z)-[2-(3,4-dimethylphenoxy)ethanoylhydrazinylidene]methyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[(Z)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazono]methyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[(Z)-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[(Z)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazinylidene]methyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[(Z)-[[2-(3,4-dimethylphenoxy)acetyl]hydrazono]methyl]-6-nitro-phenolate Formula: C17H15BrN3O5- MolecularWeight: 421.2221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Br)C

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O5/c1-10-3-4-14(5-11(10)2)26-9-16(22)20-19-8-12-6-13(18)7-15(17(12)23)21(24)25/h3-8,23H,9H2,1-2H3,(H,20,22)/p-1/b19-8-