(5-octylpyrimidin-2-yl) (E)-4-phenylbut-2-enoate

Systemtic Name: (5-octylpyrimidin-2-yl) (E)-4-phenylbut-2-enoate Openeye Name: (5-octylpyrimidin-2-yl) (E)-4-phenylbut-2-enoate CAS Name: (E)-4-phenyl-2-butenoic acid (5-octyl-2-pyrimidinyl) ester IUPAC Name: (5-octylpyrimidin-2-yl) (E)-4-phenylbut-2-enoate Traditional Name: (E)-4-phenylbut-2-enoic acid (5-octylpyrimidin-2-yl) ester Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)OC(=O)C=CCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)OC(=O)/C=C/CC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O2/c1-2-3-4-5-6-8-14-20-17-23-22(24-18-20)26-21(25)16-11-15-19-12-9-7-10-13-19/h7,9-13,16-18H,2-6,8,14-15H2,1H3/b16-11+