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

Systemtic Name: [4-bromanyl-2-[(E)-(2-phenylethanoylhydrazinylidene)methyl]phenyl] 4-methylbenzoate Openeye Name: [4-bromo-2-[(E)-[(2-phenylacetyl)hydrazono]methyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-bromo-2-[(E)-[(1-oxo-2-phenylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(2-phenylacetyl)hydrazinylidene]methyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-bromo-2-[(E)-[(2-phenylacetyl)hydrazono]methyl]phenyl] ester Formula: C23H19BrN2O3 MolecularWeight: 451.31256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H19BrN2O3/c1-16-7-9-18(10-8-16)23(28)29-21-12-11-20(24)14-19(21)15-25-26-22(27)13-17-5-3-2-4-6-17/h2-12,14-15H,13H2,1H3,(H,26,27)/b25-15+