(E)-5-butoxy-1-[4-[(E)-2-pyridin-3-ylethenyl]phenyl]pent-1-en-3-one

Systemtic Name: (E)-5-butoxy-1-[4-[(E)-2-pyridin-3-ylethenyl]phenyl]pent-1-en-3-one Openeye Name: (E)-5-butoxy-1-[4-[(E)-2-(3-pyridyl)vinyl]phenyl]pent-1-en-3-one CAS Name: (E)-5-butoxy-1-[4-[(E)-2-(3-pyridinyl)ethenyl]phenyl]-1-penten-3-one IUPAC Name: (E)-5-butoxy-1-[4-[(E)-2-pyridin-3-ylethenyl]phenyl]pent-1-en-3-one Traditional Name: (E)-5-butoxy-1-[4-[(E)-2-(3-pyridyl)vinyl]phenyl]pent-1-en-3-one Formula: C22H25NO2 MolecularWeight: 335.4394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCOCCC(=O)/C=C/C1=CC=C(C=C1)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C22H25NO2/c1-2-3-16-25-17-14-22(24)13-12-20-8-6-19(7-9-20)10-11-21-5-4-15-23-18-21/h4-13,15,18H,2-3,14,16-17H2,1H3/b11-10+,13-12+