[2-(4-dodecoxyphenyl)pyrimidin-5-yl] dodecanoate

Systemtic Name: [2-(4-dodecoxyphenyl)pyrimidin-5-yl] dodecanoate Openeye Name: [2-(4-dodecoxyphenyl)pyrimidin-5-yl] dodecanoate CAS Name: dodecanoic acid [2-(4-dodecoxyphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-dodecoxyphenyl)pyrimidin-5-yl] dodecanoate Traditional Name: lauric acid [2-(4-lauryloxyphenyl)pyrimidin-5-yl] ester Formula: C34H54N2O3 MolecularWeight: 538.80416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C34H54N2O3/c1-3-5-7-9-11-13-15-17-19-21-27-38-31-25-23-30(24-26-31)34-35-28-32(29-36-34)39-33(37)22-20-18-16-14-12-10-8-6-4-2/h23-26,28-29H,3-22,27H2,1-2H3