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

Systemtic Name: [4-(5-octoxypyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate Openeye Name: [4-(5-octoxypyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate CAS Name: (2S)-2-methylbutanoic acid [4-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octoxypyrimidin-2-yl)phenyl] (2S)-2-methylbutanoate Traditional Name: (2S)-2-methylbutyric acid [4-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)[C@@H](C)CC

InChI

InChI=1S/C23H32N2O3/c1-4-6-7-8-9-10-15-27-21-16-24-22(25-17-21)19-11-13-20(14-12-19)28-23(26)18(3)5-2/h11-14,16-18H,4-10,15H2,1-3H3/t18-/m0/s1