(4-heptoxyphenyl) 4-(5-propylpyridin-2-yl)benzoate

Systemtic Name: (4-heptoxyphenyl) 4-(5-propylpyridin-2-yl)benzoate Openeye Name: (4-heptoxyphenyl) 4-(5-propyl-2-pyridyl)benzoate CAS Name: 4-(5-propyl-2-pyridinyl)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 4-(5-propylpyridin-2-yl)benzoate Traditional Name: 4-(5-propyl-2-pyridyl)benzoic acid (4-heptoxyphenyl) ester Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC=C(C=C3)CCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC=C(C=C3)CCC

InChI

InChI=1S/C28H33NO3/c1-3-5-6-7-8-20-31-25-15-17-26(18-16-25)32-28(30)24-13-11-23(12-14-24)27-19-10-22(9-4-2)21-29-27/h10-19,21H,3-9,20H2,1-2H3