[2-[(E)-[(4-acetamidophenyl)carbonylhydrazinylidene]methyl]-4-bromanyl-phenyl] furan-2-carboxylate

Systemtic Name: [2-[(E)-[(4-acetamidophenyl)carbonylhydrazinylidene]methyl]-4-bromanyl-phenyl] furan-2-carboxylate Openeye Name: [2-[(E)-[(4-acetamidobenzoyl)hydrazono]methyl]-4-bromo-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [2-[(E)-[[(4-acetamidophenyl)-oxomethyl]hydrazinylidene]methyl]-4-bromophenyl] ester IUPAC Name: [2-[(E)-[(4-acetamidobenzoyl)hydrazinylidene]methyl]-4-bromophenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [2-[(E)-[(4-acetamidobenzoyl)hydrazono]methyl]-4-bromo-phenyl] ester Formula: C21H16BrN3O5 MolecularWeight: 470.27284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC=CO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CO3

InChI

InChI=1S/C21H16BrN3O5/c1-13(26)24-17-7-4-14(5-8-17)20(27)25-23-12-15-11-16(22)6-9-18(15)30-21(28)19-3-2-10-29-19/h2-12H,1H3,(H,24,26)(H,25,27)/b23-12+