[4-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 4-methylbenzoate Openeye Name: [4-[(E)-(pyridine-3-carbonylhydrazono)methyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[(E)-(nicotinoylhydrazono)methyl]phenyl] ester Formula: C21H17N3O3 MolecularWeight: 359.37798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O3/c1-15-4-8-17(9-5-15)21(26)27-19-10-6-16(7-11-19)13-23-24-20(25)18-3-2-12-22-14-18/h2-14H,1H3,(H,24,25)/b23-13+