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

Systemtic Name: [4-[(E)-(pyrazin-2-ylcarbonylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate Openeye Name: [4-[(E)-(pyrazine-2-carbonylhydrazono)methyl]phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[(E)-[[oxo(2-pyrazinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-(pyrazine-2-carbonylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-[(E)-(pyrazinoylhydrazono)methyl]phenyl] ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=NC=CN=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C22H20N4O4/c1-2-13-29-18-9-5-17(6-10-18)22(28)30-19-7-3-16(4-8-19)14-25-26-21(27)20-15-23-11-12-24-20/h3-12,14-15H,2,13H2,1H3,(H,26,27)/b25-14+