[4-[(E)-[(4-cyanophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-tert-butylbenzoate

Systemtic Name: [4-[(E)-[(4-cyanophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-tert-butylbenzoate Openeye Name: [4-[(E)-[(4-cyanobenzoyl)hydrazono]methyl]phenyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [4-[(E)-[[(4-cyanophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(4-cyanobenzoyl)hydrazinylidene]methyl]phenyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [4-[(E)-[(4-cyanobenzoyl)hydrazono]methyl]phenyl] ester Formula: C26H23N3O3 MolecularWeight: 425.47912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O3/c1-26(2,3)22-12-10-21(11-13-22)25(31)32-23-14-6-19(7-15-23)17-28-29-24(30)20-8-4-18(16-27)5-9-20/h4-15,17H,1-3H3,(H,29,30)/b28-17+