(E)-8-methoxy-1-[4-(2-pyridin-3-ylethyl)phenyl]oct-1-en-3-one

Systemtic Name: (E)-8-methoxy-1-[4-(2-pyridin-3-ylethyl)phenyl]oct-1-en-3-one Openeye Name: (E)-8-methoxy-1-[4-[2-(3-pyridyl)ethyl]phenyl]oct-1-en-3-one CAS Name: (E)-8-methoxy-1-[4-[2-(3-pyridinyl)ethyl]phenyl]-1-octen-3-one IUPAC Name: (E)-8-methoxy-1-[4-(2-pyridin-3-ylethyl)phenyl]oct-1-en-3-one Traditional Name: (E)-8-methoxy-1-[4-[2-(3-pyridyl)ethyl]phenyl]oct-1-en-3-one Formula: C22H27NO2 MolecularWeight: 337.45528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO2/c1-25-17-4-2-3-7-22(24)15-14-20-10-8-19(9-11-20)12-13-21-6-5-16-23-18-21/h5-6,8-11,14-16,18H,2-4,7,12-13,17H2,1H3/b15-14+