2-(4-propoxyphenoxy)ethyl 2-[2-(4-propoxyphenoxy)ethylsulfanyl]pyridine-3-carboxylate

Systemtic Name: 2-(4-propoxyphenoxy)ethyl 2-[2-(4-propoxyphenoxy)ethylsulfanyl]pyridine-3-carboxylate Openeye Name: 2-(4-propoxyphenoxy)ethyl 2-[2-(4-propoxyphenoxy)ethylsulfanyl]pyridine-3-carboxylate CAS Name: 2-[2-(4-propoxyphenoxy)ethylthio]-3-pyridinecarboxylic acid 2-(4-propoxyphenoxy)ethyl ester IUPAC Name: 2-(4-propoxyphenoxy)ethyl 2-[2-(4-propoxyphenoxy)ethylsulfanyl]pyridine-3-carboxylate Traditional Name: 2-[2-(4-propoxyphenoxy)ethylthio]nicotinic acid 2-(4-propoxyphenoxy)ethyl ester Formula: C28H33NO6S MolecularWeight: 511.62972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCOC(=O)C2=C(N=CC=C2)SCCOC3=CC=C(C=C3)OCCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCOC(=O)C2=C(N=CC=C2)SCCOC3=CC=C(C=C3)OCCC

InChI

InChI=1S/C28H33NO6S/c1-3-16-31-22-7-11-24(12-8-22)33-18-19-35-28(30)26-6-5-15-29-27(26)36-21-20-34-25-13-9-23(10-14-25)32-17-4-2/h5-15H,3-4,16-21H2,1-2H3