(5-heptylpyrimidin-2-yl) (E)-4-phenylpent-2-enoate

Systemtic Name: (5-heptylpyrimidin-2-yl) (E)-4-phenylpent-2-enoate Openeye Name: (5-heptylpyrimidin-2-yl) (E)-4-phenylpent-2-enoate CAS Name: (E)-4-phenyl-2-pentenoic acid (5-heptyl-2-pyrimidinyl) ester IUPAC Name: (5-heptylpyrimidin-2-yl) (E)-4-phenylpent-2-enoate Traditional Name: (E)-4-phenylpent-2-enoic acid (5-heptylpyrimidin-2-yl) ester Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)OC(=O)C=CC(C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)OC(=O)/C=C/C(C)C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O2/c1-3-4-5-6-8-11-19-16-23-22(24-17-19)26-21(25)15-14-18(2)20-12-9-7-10-13-20/h7,9-10,12-18H,3-6,8,11H2,1-2H3/b15-14+