[2-(2-bromophenyl)-2-oxidanylidene-ethyl] (E)-3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: [2-(2-bromophenyl)-2-oxidanylidene-ethyl] (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: [2-(2-bromophenyl)-2-oxo-ethyl] (E)-3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(methylthio)phenyl]-2-propenoic acid [2-(2-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-bromophenyl)-2-oxoethyl] (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: (E)-3-[4-(methylthio)phenyl]acrylic acid [2-(2-bromophenyl)-2-keto-ethyl] ester Formula: C18H15BrO3S MolecularWeight: 391.2789

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)OCC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)OCC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H15BrO3S/c1-23-14-9-6-13(7-10-14)8-11-18(21)22-12-17(20)15-4-2-3-5-16(15)19/h2-11H,12H2,1H3/b11-8+