pentyl 4-(4-cyanophenyl)sulfanylcarbonylbenzoate

Systemtic Name: pentyl 4-(4-cyanophenyl)sulfanylcarbonylbenzoate Openeye Name: pentyl 4-(4-cyanophenyl)sulfanylcarbonylbenzoate CAS Name: 4-[[(4-cyanophenyl)thio]-oxomethyl]benzoic acid pentyl ester IUPAC Name: pentyl 4-(4-cyanophenyl)sulfanylcarbonylbenzoate Traditional Name: 4-[(4-cyanophenyl)thio]carbonylbenzoic acid amyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H19NO3S/c1-2-3-4-13-24-19(22)16-7-9-17(10-8-16)20(23)25-18-11-5-15(14-21)6-12-18/h5-12H,2-4,13H2,1H3