[4-(5-undecylpyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate

Systemtic Name: [4-(5-undecylpyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate Openeye Name: [4-(5-undecylpyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate CAS Name: (2S)-2-methylbutanoic acid [4-(5-undecyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-undecylpyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate Traditional Name: (2S)-2-methylbutyric acid [4-(5-undecylpyrimidin-2-yl)phenyl] ester Formula: C26H38N2O2 MolecularWeight: 410.59212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)[C@@H](C)CC

InChI

InChI=1S/C26H38N2O2/c1-4-6-7-8-9-10-11-12-13-14-22-19-27-25(28-20-22)23-15-17-24(18-16-23)30-26(29)21(3)5-2/h15-21H,4-14H2,1-3H3/t21-/m0/s1