[4-(5-nonylpyridin-2-yl)phenyl] 3-propoxypropanoate

Systemtic Name: [4-(5-nonylpyridin-2-yl)phenyl] 3-propoxypropanoate Openeye Name: [4-(5-nonyl-2-pyridyl)phenyl] 3-propoxypropanoate CAS Name: 3-propoxypropanoic acid [4-(5-nonyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-nonylpyridin-2-yl)phenyl] 3-propoxypropanoate Traditional Name: 3-propoxypropionic acid [4-(5-nonyl-2-pyridyl)phenyl] ester Formula: C26H37NO3 MolecularWeight: 411.57688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37NO3/c1-3-5-6-7-8-9-10-11-22-12-17-25(27-21-22)23-13-15-24(16-14-23)30-26(28)18-20-29-19-4-2/h12-17,21H,3-11,18-20H2,1-2H3