tert-butyl (E)-3-(3-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: tert-butyl (E)-3-(3-methylsulfanylphenyl)prop-2-enoate Openeye Name: tert-butyl (E)-3-(3-methylsulfanylphenyl)prop-2-enoate CAS Name: (E)-3-[3-(methylthio)phenyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-(3-methylsulfanylphenyl)prop-2-enoate Traditional Name: (E)-3-[3-(methylthio)phenyl]acrylic acid tert-butyl ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC(=CC=C1)SC

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC(=CC=C1)SC

InChI

InChI=1S/C14H18O2S/c1-14(2,3)16-13(15)9-8-11-6-5-7-12(10-11)17-4/h5-10H,1-4H3/b9-8+