[6-[4-(5-propoxypentyl)phenyl]pyridin-3-yl] non-8-enoate

Systemtic Name: [6-[4-(5-propoxypentyl)phenyl]pyridin-3-yl] non-8-enoate Openeye Name: [6-[4-(5-propoxypentyl)phenyl]-3-pyridyl] non-8-enoate CAS Name: 8-nonenoic acid [6-[4-(5-propoxypentyl)phenyl]-3-pyridinyl] ester IUPAC Name: [6-[4-(5-propoxypentyl)phenyl]pyridin-3-yl] non-8-enoate Traditional Name: non-8-enoic acid [6-[4-(5-propoxypentyl)phenyl]-3-pyridyl] ester Formula: C28H39NO3 MolecularWeight: 437.61416

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCCCCC1=CC=C(C=C1)C2=NC=C(C=C2)OC(=O)CCCCCCC=C

Isomeric SMILES

CCCOCCCCCC1=CC=C(C=C1)C2=NC=C(C=C2)OC(=O)CCCCCCC=C

InChI

InChI=1S/C28H39NO3/c1-3-5-6-7-8-11-14-28(30)32-26-19-20-27(29-23-26)25-17-15-24(16-18-25)13-10-9-12-22-31-21-4-2/h3,15-20,23H,1,4-14,21-22H2,2H3