[4-(2-methylbutyl)phenyl] 5-nonylpyrimidine-2-carboxylate

Systemtic Name: [4-(2-methylbutyl)phenyl] 5-nonylpyrimidine-2-carboxylate Openeye Name: [4-(2-methylbutyl)phenyl] 5-nonylpyrimidine-2-carboxylate CAS Name: 5-nonyl-2-pyrimidinecarboxylic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 5-nonylpyrimidine-2-carboxylate Traditional Name: 5-nonylpyrimidine-2-carboxylic acid [4-(2-methylbutyl)phenyl] ester Formula: C25H36N2O2 MolecularWeight: 396.56554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

InChI

InChI=1S/C25H36N2O2/c1-4-6-7-8-9-10-11-12-22-18-26-24(27-19-22)25(28)29-23-15-13-21(14-16-23)17-20(3)5-2/h13-16,18-20H,4-12,17H2,1-3H3