[4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3-methylbutanoate

Systemtic Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3-methylbutanoate Openeye Name: [4-[(E)-2-(2-pyridyl)vinyl]phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-[(E)-2-(2-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-[(E)-2-(2-pyridyl)vinyl]phenyl] ester Formula: C18H19NO2 MolecularWeight: 281.34896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC1=CC=C(C=C1)C=CC2=CC=CC=N2

Isomeric SMILES

CC(C)CC(=O)OC1=CC=C(C=C1)/C=C/C2=CC=CC=N2

InChI

InChI=1S/C18H19NO2/c1-14(2)13-18(20)21-17-10-7-15(8-11-17)6-9-16-5-3-4-12-19-16/h3-12,14H,13H2,1-2H3/b9-6+