(4-decoxyphenyl) 6-phenylmethoxypyridine-3-carboxylate

Systemtic Name: (4-decoxyphenyl) 6-phenylmethoxypyridine-3-carboxylate Openeye Name: (4-decoxyphenyl) 6-benzyloxypyridine-3-carboxylate CAS Name: 6-phenylmethoxy-3-pyridinecarboxylic acid (4-decoxyphenyl) ester IUPAC Name: (4-decoxyphenyl) 6-phenylmethoxypyridine-3-carboxylate Traditional Name: 6-benzoxynicotinic acid (4-decoxyphenyl) ester Formula: C29H35NO4 MolecularWeight: 461.5925

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CN=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CN=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C29H35NO4/c1-2-3-4-5-6-7-8-12-21-32-26-16-18-27(19-17-26)34-29(31)25-15-20-28(30-22-25)33-23-24-13-10-9-11-14-24/h9-11,13-20,22H,2-8,12,21,23H2,1H3