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

Systemtic Name: [4-(2-methylbutyl)phenyl] 5-octylpyrimidine-2-carboxylate Openeye Name: [4-(2-methylbutyl)phenyl] 5-octylpyrimidine-2-carboxylate CAS Name: 5-octyl-2-pyrimidinecarboxylic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 5-octylpyrimidine-2-carboxylate Traditional Name: 5-octylpyrimidine-2-carboxylic acid [4-(2-methylbutyl)phenyl] ester Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

InChI

InChI=1S/C24H34N2O2/c1-4-6-7-8-9-10-11-21-17-25-23(26-18-21)24(27)28-22-14-12-20(13-15-22)16-19(3)5-2/h12-15,17-19H,4-11,16H2,1-3H3