[4-(4-cyanophenyl)sulfanylcarbonylphenyl] hexanoate

Systemtic Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] hexanoate Openeye Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] hexanoate CAS Name: hexanoic acid [4-[[(4-cyanophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] hexanoate Traditional Name: hexanoic acid [4-[(4-cyanophenyl)thio]carbonylphenyl] ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H19NO3S/c1-2-3-4-5-19(22)24-17-10-8-16(9-11-17)20(23)25-18-12-6-15(14-21)7-13-18/h6-13H,2-5H2,1H3