[4-(4-cyanophenyl)sulfanylcarbonylphenyl] undecanoate

Systemtic Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] undecanoate Openeye Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] undecanoate CAS Name: undecanoic acid [4-[[(4-cyanophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] undecanoate Traditional Name: undecanoic acid [4-[(4-cyanophenyl)thio]carbonylphenyl] ester Formula: C25H29NO3S MolecularWeight: 423.56766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO3S/c1-2-3-4-5-6-7-8-9-10-24(27)29-22-15-13-21(14-16-22)25(28)30-23-17-11-20(19-26)12-18-23/h11-18H,2-10H2,1H3