[4-(5-propylpyridin-2-yl)phenyl] 4-butylbenzoate

Systemtic Name: [4-(5-propylpyridin-2-yl)phenyl] 4-butylbenzoate Openeye Name: [4-(5-propyl-2-pyridyl)phenyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [4-(5-propyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-propylpyridin-2-yl)phenyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [4-(5-propyl-2-pyridyl)phenyl] ester Formula: C25H27NO2 MolecularWeight: 373.48738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=C3)CCC

InChI

InChI=1S/C25H27NO2/c1-3-5-7-19-8-11-22(12-9-19)25(27)28-23-15-13-21(14-16-23)24-17-10-20(6-4-2)18-26-24/h8-18H,3-7H2,1-2H3