[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C19H19ClO3S MolecularWeight: 362.87036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H19ClO3S/c1-13-3-4-14(2)17(11-13)18(21)12-23-19(22)9-10-24-16-7-5-15(20)6-8-16/h3-8,11H,9-10,12H2,1-2H3