ethyl (E)-3-phenyl-2-phenylsulfanyl-but-2-enoate

Systemtic Name: ethyl (E)-3-phenyl-2-phenylsulfanyl-but-2-enoate Openeye Name: ethyl (E)-3-phenyl-2-phenylsulfanyl-but-2-enoate CAS Name: (E)-3-phenyl-2-(phenylthio)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-phenyl-2-phenylsulfanylbut-2-enoate Traditional Name: (E)-3-phenyl-2-(phenylthio)but-2-enoic acid ethyl ester Formula: C18H18O2S MolecularWeight: 298.39932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)C1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C(=C(/C)\C1=CC=CC=C1)/SC2=CC=CC=C2

InChI

InChI=1S/C18H18O2S/c1-3-20-18(19)17(21-16-12-8-5-9-13-16)14(2)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3/b17-14+