[4-bromanyl-2-[(E)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]phenyl] 4-ethoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]phenyl] 4-ethoxybenzoate Openeye Name: [4-bromo-2-[(E)-(pyridine-4-carbonylhydrazono)methyl]phenyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [4-bromo-2-[(E)-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [4-bromo-2-[(E)-(isonicotinoylhydrazono)methyl]phenyl] ester Formula: C22H18BrN3O4 MolecularWeight: 468.30002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)C3=CC=NC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C22H18BrN3O4/c1-2-29-19-6-3-16(4-7-19)22(28)30-20-8-5-18(23)13-17(20)14-25-26-21(27)15-9-11-24-12-10-15/h3-14H,2H2,1H3,(H,26,27)/b25-14+