[4-(5-nonylpyridin-2-yl)phenyl] 2-methylbutanoate

Systemtic Name: [4-(5-nonylpyridin-2-yl)phenyl] 2-methylbutanoate Openeye Name: [4-(5-nonyl-2-pyridyl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [4-(5-nonyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-nonylpyridin-2-yl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [4-(5-nonyl-2-pyridyl)phenyl] ester Formula: C25H35NO2 MolecularWeight: 381.5509

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C)CC

InChI

InChI=1S/C25H35NO2/c1-4-6-7-8-9-10-11-12-21-13-18-24(26-19-21)22-14-16-23(17-15-22)28-25(27)20(3)5-2/h13-20H,4-12H2,1-3H3