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

Systemtic Name: [(E)-2-(3-butoxyphenoxy)-4,4-dimethyl-1-pyridin-3-yl-pent-1-en-3-yl] ethanoate Openeye Name: [(E)-2-(3-butoxyphenoxy)-1-tert-butyl-3-(3-pyridyl)allyl] acetate CAS Name: acetic acid [(E)-2-(3-butoxyphenoxy)-4,4-dimethyl-1-(3-pyridinyl)pent-1-en-3-yl] ester IUPAC Name: [(E)-2-(3-butoxyphenoxy)-4,4-dimethyl-1-pyridin-3-ylpent-1-en-3-yl] acetate Traditional Name: acetic acid [(E)-2-(3-butoxyphenoxy)-1-tert-butyl-3-(3-pyridyl)allyl] ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)OC(=CC2=CN=CC=C2)C(C(C)(C)C)OC(=O)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)O/C(=C/C2=CN=CC=C2)/C(C(C)(C)C)OC(=O)C

InChI

InChI=1S/C24H31NO4/c1-6-7-14-27-20-11-8-12-21(16-20)29-22(15-19-10-9-13-25-17-19)23(24(3,4)5)28-18(2)26/h8-13,15-17,23H,6-7,14H2,1-5H3/b22-15+