(5-pentylpyrimidin-2-yl) (E)-4-phenylhept-2-enoate

Systemtic Name: (5-pentylpyrimidin-2-yl) (E)-4-phenylhept-2-enoate Openeye Name: (5-pentylpyrimidin-2-yl) (E)-4-phenylhept-2-enoate CAS Name: (E)-4-phenyl-2-heptenoic acid (5-pentyl-2-pyrimidinyl) ester IUPAC Name: (5-pentylpyrimidin-2-yl) (E)-4-phenylhept-2-enoate Traditional Name: (E)-4-phenylhept-2-enoic acid (5-amylpyrimidin-2-yl) ester Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)OC(=O)C=CC(CCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1=CN=C(N=C1)OC(=O)/C=C/C(CCC)C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O2/c1-3-5-7-11-18-16-23-22(24-17-18)26-21(25)15-14-19(10-4-2)20-12-8-6-9-13-20/h6,8-9,12-17,19H,3-5,7,10-11H2,1-2H3/b15-14+