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

Systemtic Name: [4-bromanyl-2-[(E)-(pyrazin-2-ylcarbonylhydrazinylidene)methyl]phenyl] 4-ethoxybenzoate Openeye Name: [4-bromo-2-[(E)-(pyrazine-2-carbonylhydrazono)methyl]phenyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [4-bromo-2-[(E)-[[oxo(2-pyrazinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(pyrazine-2-carbonylhydrazinylidene)methyl]phenyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [4-bromo-2-[(E)-(pyrazinoylhydrazono)methyl]phenyl] ester Formula: C21H17BrN4O4 MolecularWeight: 469.28808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN4O4/c1-2-29-17-6-3-14(4-7-17)21(28)30-19-8-5-16(22)11-15(19)12-25-26-20(27)18-13-23-9-10-24-18/h3-13H,2H2,1H3,(H,26,27)/b25-12+