[4-bromanyl-2-[(E)-[2-(2-nitrophenoxy)propanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-(2-nitrophenoxy)propanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [4-bromo-2-[(E)-[2-(2-nitrophenoxy)propanoylhydrazono]methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[[2-(2-nitrophenoxy)-1-oxopropyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[2-(2-nitrophenoxy)propanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[2-(2-nitrophenoxy)propanoylhydrazono]methyl]phenyl] ester Formula: C24H20BrN3O6 MolecularWeight: 526.3361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)C(C)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C(C)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C24H20BrN3O6/c1-15-6-5-7-17(12-15)24(30)34-21-11-10-19(25)13-18(21)14-26-27-23(29)16(2)33-22-9-4-3-8-20(22)28(31)32/h3-14,16H,1-2H3,(H,27,29)/b26-14+