2-(4-cyanophenoxy)ethyl 2-[2-(4-cyanophenoxy)ethylsulfanyl]benzoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 2-[2-(4-cyanophenoxy)ethylsulfanyl]benzoate Openeye Name: 2-(4-cyanophenoxy)ethyl 2-[2-(4-cyanophenoxy)ethylsulfanyl]benzoate CAS Name: 2-[2-(4-cyanophenoxy)ethylthio]benzoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 2-[2-(4-cyanophenoxy)ethylsulfanyl]benzoate Traditional Name: 2-[2-(4-cyanophenoxy)ethylthio]benzoic acid 2-(4-cyanophenoxy)ethyl ester Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCCOC2=CC=C(C=C2)C#N)SCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCCOC2=CC=C(C=C2)C#N)SCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H20N2O4S/c26-17-19-5-9-21(10-6-19)29-13-14-31-25(28)23-3-1-2-4-24(23)32-16-15-30-22-11-7-20(18-27)8-12-22/h1-12H,13-16H2