heptyl 4-(5-hexylpyrimidin-2-yl)benzoate

Systemtic Name: heptyl 4-(5-hexylpyrimidin-2-yl)benzoate Openeye Name: heptyl 4-(5-hexylpyrimidin-2-yl)benzoate CAS Name: 4-(5-hexyl-2-pyrimidinyl)benzoic acid heptyl ester IUPAC Name: heptyl 4-(5-hexylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-hexylpyrimidin-2-yl)benzoic acid heptyl ester Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCC

Isomeric SMILES

CCCCCCCOC(=O)C1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCC

InChI

InChI=1S/C24H34N2O2/c1-3-5-7-9-11-17-28-24(27)22-15-13-21(14-16-22)23-25-18-20(19-26-23)12-10-8-6-4-2/h13-16,18-19H,3-12,17H2,1-2H3