hexyl 2-oxidanylidene-3-(4-phenylphenyl)sulfanyl-propanoate

Systemtic Name: hexyl 2-oxidanylidene-3-(4-phenylphenyl)sulfanyl-propanoate Openeye Name: hexyl 2-oxo-3-(4-phenylphenyl)sulfanyl-propanoate CAS Name: 2-oxo-3-[(4-phenylphenyl)thio]propanoic acid hexyl ester IUPAC Name: hexyl 2-oxo-3-(4-phenylphenyl)sulfanylpropanoate Traditional Name: 2-keto-3-[(4-phenylphenyl)thio]propionic acid hexyl ester Formula: C21H24O3S MolecularWeight: 356.47846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=O)CSC1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCOC(=O)C(=O)CSC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H24O3S/c1-2-3-4-8-15-24-21(23)20(22)16-25-19-13-11-18(12-14-19)17-9-6-5-7-10-17/h5-7,9-14H,2-4,8,15-16H2,1H3