[4-[(E)-(2-phenylazanylethanoylhydrazinylidene)methyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[(E)-(2-phenylazanylethanoylhydrazinylidene)methyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-[(E)-[(2-anilinoacetyl)hydrazono]methyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(E)-[(2-anilino-1-oxoethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-anilinoacetyl)hydrazinylidene]methyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(E)-[(2-anilinoacetyl)hydrazono]methyl]phenyl] ester Formula: C22H18BrN3O3 MolecularWeight: 452.30062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18BrN3O3/c23-18-10-8-17(9-11-18)22(28)29-20-12-6-16(7-13-20)14-25-26-21(27)15-24-19-4-2-1-3-5-19/h1-14,24H,15H2,(H,26,27)/b25-14+