(4-hexoxyphenyl) 5-heptylpyridine-2-carboxylate

Systemtic Name: (4-hexoxyphenyl) 5-heptylpyridine-2-carboxylate Openeye Name: (4-hexoxyphenyl) 5-heptylpyridine-2-carboxylate CAS Name: 5-heptyl-2-pyridinecarboxylic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 5-heptylpyridine-2-carboxylate Traditional Name: 5-heptylpicolinic acid (4-hexoxyphenyl) ester Formula: C25H35NO3 MolecularWeight: 397.5503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCCCC

Isomeric SMILES

CCCCCCCC1=CN=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCCCC

InChI

InChI=1S/C25H35NO3/c1-3-5-7-9-10-12-21-13-18-24(26-20-21)25(27)29-23-16-14-22(15-17-23)28-19-11-8-6-4-2/h13-18,20H,3-12,19H2,1-2H3