2-(4-tert-butylphenyl)-7-[(E)-2-pyridin-2-ylethenyl]-3H-isoindol-1-one

Systemtic Name: 2-(4-tert-butylphenyl)-7-[(E)-2-pyridin-2-ylethenyl]-3H-isoindol-1-one Openeye Name: 2-(4-tert-butylphenyl)-7-[(E)-2-(2-pyridyl)vinyl]isoindolin-1-one CAS Name: 2-(4-tert-butylphenyl)-7-[(E)-2-(2-pyridinyl)ethenyl]-3H-isoindol-1-one IUPAC Name: 2-(4-tert-butylphenyl)-7-[(E)-2-pyridin-2-ylethenyl]-3H-isoindol-1-one Traditional Name: 2-(4-tert-butylphenyl)-7-[(E)-2-(2-pyridyl)vinyl]isoindolin-1-one Formula: C25H24N2O MolecularWeight: 368.47086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CC3=CC=CC(=C3C2=O)C=CC4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CC3=CC=CC(=C3C2=O)/C=C/C4=CC=CC=N4

InChI

InChI=1S/C25H24N2O/c1-25(2,3)20-11-14-22(15-12-20)27-17-19-8-6-7-18(23(19)24(27)28)10-13-21-9-4-5-16-26-21/h4-16H,17H2,1-3H3/b13-10+