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5-nonyl-3-(4-octoxyphenyl)pyridine-2-carboxylate

5-nonyl-3-(4-octoxyphenyl)pyridine-2-carboxylate

Systemtic Name:5-nonyl-3-(4-octoxyphenyl)pyridine-2-carboxylate
Openeye Name:5-nonyl-3-(4-octoxyphenyl)pyridine-2-carboxylate
CAS Name:5-nonyl-3-(4-octoxyphenyl)-2-pyridinecarboxylate
IUPAC Name:5-nonyl-3-(4-octoxyphenyl)pyridine-2-carboxylate
Traditional Name:5-nonyl-3-(4-octoxyphenyl)picolinate
Formula: C29H42NO3-
MolecularWeight: 452.64868
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C(=C1)C2=CC=C(C=C2)OCCCCCCCC)C(=O)[O-]


Isomeric SMILES

CCCCCCCCCC1=CN=C(C(=C1)C2=CC=C(C=C2)OCCCCCCCC)C(=O)[O-]


InChI

InChI=1S/C29H43NO3/c1-3-5-7-9-11-12-14-16-24-22-27(28(29(31)32)30-23-24)25-17-19-26(20-18-25)33-21-15-13-10-8-6-4-2/h17-20,22-23H,3-16,21H2,1-2H3,(H,31,32)/p-1


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