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

Systemtic Name: heptoxymethyl 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylate Openeye Name: heptoxymethyl 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylate CAS Name: 2-(6-methyloctoxy)-4-phenyl-5-pyrimidinecarboxylic acid heptoxymethyl ester IUPAC Name: heptoxymethyl 2-(6-methyloctoxy)-4-phenylpyrimidine-5-carboxylate Traditional Name: 2-(6-methyloctoxy)-4-phenyl-pyrimidine-5-carboxylic acid heptoxymethyl ester Formula: C28H42N2O4 MolecularWeight: 470.64408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H42N2O4/c1-4-6-7-8-14-19-32-22-34-27(31)25-21-29-28(30-26(25)24-17-12-9-13-18-24)33-20-15-10-11-16-23(3)5-2/h9,12-13,17-18,21,23H,4-8,10-11,14-16,19-20,22H2,1-3H3