[4-(2-butanoyloxypropanoyl)phenyl] 4-(5-heptylpyridin-2-yl)benzoate

Systemtic Name: [4-(2-butanoyloxypropanoyl)phenyl] 4-(5-heptylpyridin-2-yl)benzoate Openeye Name: [4-(2-butanoyloxypropanoyl)phenyl] 4-(5-heptyl-2-pyridyl)benzoate CAS Name: 4-(5-heptyl-2-pyridinyl)benzoic acid [4-[1-oxo-2-(1-oxobutoxy)propyl]phenyl] ester IUPAC Name: [4-(2-butanoyloxypropanoyl)phenyl] 4-(5-heptylpyridin-2-yl)benzoate Traditional Name: 4-(5-heptyl-2-pyridyl)benzoic acid [4-(2-butyryloxypropanoyl)phenyl] ester Formula: C32H37NO5 MolecularWeight: 515.63988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)C(C)OC(=O)CCC

Isomeric SMILES

CCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)C(C)OC(=O)CCC

InChI

InChI=1S/C32H37NO5/c1-4-6-7-8-9-11-24-12-21-29(33-22-24)25-13-15-27(16-14-25)32(36)38-28-19-17-26(18-20-28)31(35)23(3)37-30(34)10-5-2/h12-23H,4-11H2,1-3H3