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

Systemtic Name: [4-(2-methylbutyl)phenyl] 5-heptylpyrimidine-2-carboxylate Openeye Name: [4-(2-methylbutyl)phenyl] 5-heptylpyrimidine-2-carboxylate CAS Name: 5-heptyl-2-pyrimidinecarboxylic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 5-heptylpyrimidine-2-carboxylate Traditional Name: 5-heptylpyrimidine-2-carboxylic acid [4-(2-methylbutyl)phenyl] ester Formula: C23H32N2O2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

InChI

InChI=1S/C23H32N2O2/c1-4-6-7-8-9-10-20-16-24-22(25-17-20)23(26)27-21-13-11-19(12-14-21)15-18(3)5-2/h11-14,16-18H,4-10,15H2,1-3H3