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

Systemtic Name: (4-heptoxyphenyl) 4-(5-pentylpyridin-2-yl)benzoate Openeye Name: (4-heptoxyphenyl) 4-(5-pentyl-2-pyridyl)benzoate CAS Name: 4-(5-pentyl-2-pyridinyl)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 4-(5-pentylpyridin-2-yl)benzoate Traditional Name: 4-(5-amyl-2-pyridyl)benzoic acid (4-heptoxyphenyl) ester Formula: C30H37NO3 MolecularWeight: 459.61968

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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)CCCCC

Isomeric SMILES

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

InChI

InChI=1S/C30H37NO3/c1-3-5-7-8-10-22-33-27-17-19-28(20-18-27)34-30(32)26-15-13-25(14-16-26)29-21-12-24(23-31-29)11-9-6-4-2/h12-21,23H,3-11,22H2,1-2H3