[4-[(E)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[(E)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[(E)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(E)-[(1-oxo-2-thiophen-2-ylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-thiophen-2-ylacetyl)hydrazinylidene]methyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenyl] ester Formula: C20H15BrN2O3S MolecularWeight: 443.3137

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)C=NNC(=O)CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)CC3=CC=CS3

InChI

InChI=1S/C20H15BrN2O3S/c21-16-4-1-3-15(11-16)20(25)26-17-8-6-14(7-9-17)13-22-23-19(24)12-18-5-2-10-27-18/h1-11,13H,12H2,(H,23,24)/b22-13+