(5-octylpyridin-2-yl) (E)-4-phenyldec-2-enoate

Systemtic Name: (5-octylpyridin-2-yl) (E)-4-phenyldec-2-enoate Openeye Name: (5-octyl-2-pyridyl) (E)-4-phenyldec-2-enoate CAS Name: (E)-4-phenyl-2-decenoic acid (5-octyl-2-pyridinyl) ester IUPAC Name: (5-octylpyridin-2-yl) (E)-4-phenyldec-2-enoate Traditional Name: (E)-4-phenyldec-2-enoic acid (5-octyl-2-pyridyl) ester Formula: C29H41NO2 MolecularWeight: 435.64134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)OC(=O)C=CC(CCCCCC)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C29H41NO2/c1-3-5-7-9-10-12-16-25-20-22-28(30-24-25)32-29(31)23-21-27(19-13-8-6-4-2)26-17-14-11-15-18-26/h11,14-15,17-18,20-24,27H,3-10,12-13,16,19H2,1-2H3/b23-21+