(E)-6-ethoxy-1-[4-(2-pyridin-3-ylethyl)phenyl]hex-1-en-3-one

Systemtic Name: (E)-6-ethoxy-1-[4-(2-pyridin-3-ylethyl)phenyl]hex-1-en-3-one Openeye Name: (E)-6-ethoxy-1-[4-[2-(3-pyridyl)ethyl]phenyl]hex-1-en-3-one CAS Name: (E)-6-ethoxy-1-[4-[2-(3-pyridinyl)ethyl]phenyl]-1-hexen-3-one IUPAC Name: (E)-6-ethoxy-1-[4-(2-pyridin-3-ylethyl)phenyl]hex-1-en-3-one Traditional Name: (E)-6-ethoxy-1-[4-[2-(3-pyridyl)ethyl]phenyl]hex-1-en-3-one Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCC(=O)C=CC1=CC=C(C=C1)CCC2=CN=CC=C2

Isomeric SMILES

CCOCCCC(=O)/C=C/C1=CC=C(C=C1)CCC2=CN=CC=C2

InChI

InChI=1S/C21H25NO2/c1-2-24-16-4-6-21(23)14-13-19-9-7-18(8-10-19)11-12-20-5-3-15-22-17-20/h3,5,7-10,13-15,17H,2,4,6,11-12,16H2,1H3/b14-13+