[4-[(E)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-(pyridine-4-carbonylhydrazono)methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-(isonicotinoylhydrazono)methyl]phenyl] ester Formula: C24H23N3O4 MolecularWeight: 417.45712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC=NC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C24H23N3O4/c1-2-3-16-30-21-10-6-20(7-11-21)24(29)31-22-8-4-18(5-9-22)17-26-27-23(28)19-12-14-25-15-13-19/h4-15,17H,2-3,16H2,1H3,(H,27,28)/b26-17+