[2-(4-nonylpyrimidin-2-yl)phenyl] 4-methylhexanoate

Systemtic Name: [2-(4-nonylpyrimidin-2-yl)phenyl] 4-methylhexanoate Openeye Name: [2-(4-nonylpyrimidin-2-yl)phenyl] 4-methylhexanoate CAS Name: 4-methylhexanoic acid [2-(4-nonyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-(4-nonylpyrimidin-2-yl)phenyl] 4-methylhexanoate Traditional Name: 4-methylhexanoic acid [2-(4-nonylpyrimidin-2-yl)phenyl] ester Formula: C26H38N2O2 MolecularWeight: 410.59212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OC(=O)CCC(C)CC

Isomeric SMILES

CCCCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OC(=O)CCC(C)CC

InChI

InChI=1S/C26H38N2O2/c1-4-6-7-8-9-10-11-14-22-19-20-27-26(28-22)23-15-12-13-16-24(23)30-25(29)18-17-21(3)5-2/h12-13,15-16,19-21H,4-11,14,17-18H2,1-3H3