[4-(5-butylpyrimidin-2-yl)phenyl] 2-propylpentanoate

Systemtic Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-propylpentanoate Openeye Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-propylpentanoate CAS Name: 2-propylpentanoic acid [4-(5-butyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-propylpentanoate Traditional Name: 2-propylvaleric acid [4-(5-butylpyrimidin-2-yl)phenyl] ester Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

InChI

InChI=1S/C22H30N2O2/c1-4-7-10-17-15-23-21(24-16-17)18-11-13-20(14-12-18)26-22(25)19(8-5-2)9-6-3/h11-16,19H,4-10H2,1-3H3