ethyl 2-[4-(4-octadecylsulfanylphenyl)phenyl]ethanoate

Systemtic Name: ethyl 2-[4-(4-octadecylsulfanylphenyl)phenyl]ethanoate Openeye Name: ethyl 2-[4-(4-octadecylsulfanylphenyl)phenyl]acetate CAS Name: 2-[4-[4-(octadecylthio)phenyl]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-octadecylsulfanylphenyl)phenyl]acetate Traditional Name: 2-[4-[4-(stearylthio)phenyl]phenyl]acetic acid ethyl ester Formula: C34H52O2S MolecularWeight: 524.84048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCC

InChI

InChI=1S/C34H52O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28-37-33-26-24-32(25-27-33)31-22-20-30(21-23-31)29-34(35)36-4-2/h20-27H,3-19,28-29H2,1-2H3