(5-heptylpyridin-2-yl) (E)-4-phenyldodec-2-enoate

Systemtic Name: (5-heptylpyridin-2-yl) (E)-4-phenyldodec-2-enoate Openeye Name: (5-heptyl-2-pyridyl) (E)-4-phenyldodec-2-enoate CAS Name: (E)-4-phenyl-2-dodecenoic acid (5-heptyl-2-pyridinyl) ester IUPAC Name: (5-heptylpyridin-2-yl) (E)-4-phenyldodec-2-enoate Traditional Name: (E)-4-phenyldodec-2-enoic acid (5-heptyl-2-pyridyl) ester Formula: C30H43NO2 MolecularWeight: 449.66792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC(=O)OC1=NC=C(C=C1)CCCCCCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC(/C=C/C(=O)OC1=NC=C(C=C1)CCCCCCC)C2=CC=CC=C2

InChI

InChI=1S/C30H43NO2/c1-3-5-7-9-11-14-20-28(27-18-15-12-16-19-27)22-24-30(32)33-29-23-21-26(25-31-29)17-13-10-8-6-4-2/h12,15-16,18-19,21-25,28H,3-11,13-14,17,20H2,1-2H3/b24-22+