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

Systemtic Name: [4-bromanyl-2-[(E)-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]methyl]phenyl] 2-methylbenzoate Openeye Name: [4-bromo-2-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-bromo-2-[(E)-[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-bromo-2-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C23H18BrN3O6 MolecularWeight: 512.30952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H18BrN3O6/c1-15-4-2-3-5-20(15)23(29)33-21-11-6-17(24)12-16(21)13-25-26-22(28)14-32-19-9-7-18(8-10-19)27(30)31/h2-13H,14H2,1H3,(H,26,28)/b25-13+