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undecyl 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylate

undecyl 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylate

Systemtic Name:undecyl 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylate
Openeye Name:undecyl 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylate
CAS Name:2-(6-methyloctoxy)-4-phenyl-5-pyrimidinecarboxylic acid undecyl ester
IUPAC Name:undecyl 2-(6-methyloctoxy)-4-phenylpyrimidine-5-carboxylate
Traditional Name:2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylic acid undecyl ester
Formula: C31H48N2O3
MolecularWeight: 496.72442
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=CN=C(N=C1C2=CC=CC=C2)OCCCCCC(C)CC


Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=CN=C(N=C1C2=CC=CC=C2)OCCCCCC(C)CC


InChI

InChI=1S/C31H48N2O3/c1-4-6-7-8-9-10-11-12-18-23-35-30(34)28-25-32-31(33-29(28)27-21-16-13-17-22-27)36-24-19-14-15-20-26(3)5-2/h13,16-17,21-22,25-26H,4-12,14-15,18-20,23-24H2,1-3H3


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