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

Systemtic Name: [4-(2-methylbutyl)phenyl] 5-butylpyrimidine-2-carboxylate Openeye Name: [4-(2-methylbutyl)phenyl] 5-butylpyrimidine-2-carboxylate CAS Name: 5-butyl-2-pyrimidinecarboxylic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 5-butylpyrimidine-2-carboxylate Traditional Name: 5-butylpyrimidine-2-carboxylic acid [4-(2-methylbutyl)phenyl] ester Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC

InChI

InChI=1S/C20H26N2O2/c1-4-6-7-17-13-21-19(22-14-17)20(23)24-18-10-8-16(9-11-18)12-15(3)5-2/h8-11,13-15H,4-7,12H2,1-3H3