[4-[4-(4-cyanophenyl)sulfanylcarbonylphenyl]phenyl] hexanoate

Systemtic Name: [4-[4-(4-cyanophenyl)sulfanylcarbonylphenyl]phenyl] hexanoate Openeye Name: [4-[4-(4-cyanophenyl)sulfanylcarbonylphenyl]phenyl] hexanoate CAS Name: hexanoic acid [4-[4-[[(4-cyanophenyl)thio]-oxomethyl]phenyl]phenyl] ester IUPAC Name: [4-[4-(4-cyanophenyl)sulfanylcarbonylphenyl]phenyl] hexanoate Traditional Name: hexanoic acid [4-[4-[(4-cyanophenyl)thio]carbonylphenyl]phenyl] ester Formula: C26H23NO3S MolecularWeight: 429.53072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)SC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)SC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H23NO3S/c1-2-3-4-5-25(28)30-23-14-12-21(13-15-23)20-8-10-22(11-9-20)26(29)31-24-16-6-19(18-27)7-17-24/h6-17H,2-5H2,1H3