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

Systemtic Name: (5-pentylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate Openeye Name: (5-pentylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate CAS Name: (E)-4-phenyl-2-undecenoic acid (5-pentyl-2-pyrimidinyl) ester IUPAC Name: (5-pentylpyrimidin-2-yl) (E)-4-phenylundec-2-enoate Traditional Name: (E)-4-phenylundec-2-enoic acid (5-amylpyrimidin-2-yl) ester Formula: C26H36N2O2 MolecularWeight: 408.57624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C=CC(=O)OC1=NC=C(C=N1)CCCCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(/C=C/C(=O)OC1=NC=C(C=N1)CCCCC)C2=CC=CC=C2

InChI

InChI=1S/C26H36N2O2/c1-3-5-7-8-11-17-24(23-15-12-9-13-16-23)18-19-25(29)30-26-27-20-22(21-28-26)14-10-6-4-2/h9,12-13,15-16,18-21,24H,3-8,10-11,14,17H2,1-2H3/b19-18+