ethyl 2-(2,6-dimethylphenyl)sulfanylbut-3-enoate

Systemtic Name: ethyl 2-(2,6-dimethylphenyl)sulfanylbut-3-enoate Openeye Name: ethyl 2-(2,6-dimethylphenyl)sulfanylbut-3-enoate CAS Name: 2-[(2,6-dimethylphenyl)thio]-3-butenoic acid ethyl ester IUPAC Name: ethyl 2-(2,6-dimethylphenyl)sulfanylbut-3-enoate Traditional Name: 2-[(2,6-dimethylphenyl)thio]but-3-enoic acid ethyl ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=C)SC1=C(C=CC=C1C)C

Isomeric SMILES

CCOC(=O)C(C=C)SC1=C(C=CC=C1C)C

InChI

InChI=1S/C14H18O2S/c1-5-12(14(15)16-6-2)17-13-10(3)8-7-9-11(13)4/h5,7-9,12H,1,6H2,2-4H3