[(E)-2-(2,4-dimethylphenoxy)-4,4-dimethyl-1-pyridin-3-yl-pent-1-en-3-yl] ethanoate

Systemtic Name: [(E)-2-(2,4-dimethylphenoxy)-4,4-dimethyl-1-pyridin-3-yl-pent-1-en-3-yl] ethanoate Openeye Name: [(E)-1-tert-butyl-2-(2,4-dimethylphenoxy)-3-(3-pyridyl)allyl] acetate CAS Name: acetic acid [(E)-2-(2,4-dimethylphenoxy)-4,4-dimethyl-1-(3-pyridinyl)pent-1-en-3-yl] ester IUPAC Name: [(E)-2-(2,4-dimethylphenoxy)-4,4-dimethyl-1-pyridin-3-ylpent-1-en-3-yl] acetate Traditional Name: acetic acid [(E)-1-tert-butyl-2-(2,4-dimethylphenoxy)-3-(3-pyridyl)allyl] ester Formula: C22H27NO3 MolecularWeight: 353.45468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=CC2=CN=CC=C2)C(C(C)(C)C)OC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)O/C(=C/C2=CN=CC=C2)/C(C(C)(C)C)OC(=O)C)C

InChI

InChI=1S/C22H27NO3/c1-15-9-10-19(16(2)12-15)26-20(13-18-8-7-11-23-14-18)21(22(4,5)6)25-17(3)24/h7-14,21H,1-6H3/b20-13+