nonyl 4-(5-dodecylpyrimidin-2-yl)benzoate

Systemtic Name: nonyl 4-(5-dodecylpyrimidin-2-yl)benzoate Openeye Name: nonyl 4-(5-dodecylpyrimidin-2-yl)benzoate CAS Name: 4-(5-dodecyl-2-pyrimidinyl)benzoic acid nonyl ester IUPAC Name: nonyl 4-(5-dodecylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-laurylpyrimidin-2-yl)benzoic acid nonyl ester Formula: C32H50N2O2 MolecularWeight: 494.7516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCCCCCCCCC

InChI

InChI=1S/C32H50N2O2/c1-3-5-7-9-11-12-13-14-16-18-20-28-26-33-31(34-27-28)29-21-23-30(24-22-29)32(35)36-25-19-17-15-10-8-6-4-2/h21-24,26-27H,3-20,25H2,1-2H3