(E)-3-(1-phenylsulfanylcyclohexyl)prop-2-enal

Systemtic Name: (E)-3-(1-phenylsulfanylcyclohexyl)prop-2-enal Openeye Name: (E)-3-(1-phenylsulfanylcyclohexyl)prop-2-enal CAS Name: (E)-3-[1-(phenylthio)cyclohexyl]-2-propenal IUPAC Name: (E)-3-(1-phenylsulfanylcyclohexyl)prop-2-enal Traditional Name: (E)-3-[1-(phenylthio)cyclohexyl]acrolein Formula: C15H18OS MolecularWeight: 246.36782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C=CC=O)SC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)(/C=C/C=O)SC2=CC=CC=C2

InChI

InChI=1S/C15H18OS/c16-13-7-12-15(10-5-2-6-11-15)17-14-8-3-1-4-9-14/h1,3-4,7-9,12-13H,2,5-6,10-11H2/b12-7+