6-[1-[(4-prop-2-enoxy-3-prop-2-enyl-phenyl)methyl]piperidin-4-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[1-[(4-prop-2-enoxy-3-prop-2-enyl-phenyl)methyl]piperidin-4-yl]-1H-pyrimidin-4-one Openeye Name: 6-[1-[(3-allyl-4-allyloxy-phenyl)methyl]-4-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[1-[(4-prop-2-enoxy-3-prop-2-enylphenyl)methyl]-4-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[1-[(4-prop-2-enoxy-3-prop-2-enylphenyl)methyl]piperidin-4-yl]-1H-pyrimidin-4-one Traditional Name: 6-[1-(3-allyl-4-allyloxy-benzyl)-4-piperidyl]-1H-pyrimidin-4-one Formula: C22H27N3O2 MolecularWeight: 365.46868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)CN2CCC(CC2)C3=CC(=O)N=CN3)OCC=C

Isomeric SMILES

C=CCC1=C(C=CC(=C1)CN2CCC(CC2)C3=CC(=O)N=CN3)OCC=C

InChI

InChI=1S/C22H27N3O2/c1-3-5-19-13-17(6-7-21(19)27-12-4-2)15-25-10-8-18(9-11-25)20-14-22(26)24-16-23-20/h3-4,6-7,13-14,16,18H,1-2,5,8-12,15H2,(H,23,24,26)