ethyl 2-(2-methylphenyl)sulfanylbut-3-enoate

Systemtic Name: ethyl 2-(2-methylphenyl)sulfanylbut-3-enoate Openeye Name: ethyl 2-(o-tolylsulfanyl)but-3-enoate CAS Name: 2-[(2-methylphenyl)thio]-3-butenoic acid ethyl ester IUPAC Name: ethyl 2-(2-methylphenyl)sulfanylbut-3-enoate Traditional Name: 2-(o-tolylthio)but-3-enoic acid ethyl ester Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O2S/c1-4-11(13(14)15-5-2)16-12-9-7-6-8-10(12)3/h4,6-9,11H,1,5H2,2-3H3