(E)-3-[2-(methylsulfanylmethyl)phenyl]prop-2-enal

Systemtic Name: (E)-3-[2-(methylsulfanylmethyl)phenyl]prop-2-enal Openeye Name: (E)-3-[2-(methylsulfanylmethyl)phenyl]prop-2-enal CAS Name: (E)-3-[2-[(methylthio)methyl]phenyl]-2-propenal IUPAC Name: (E)-3-[2-(methylsulfanylmethyl)phenyl]prop-2-enal Traditional Name: (E)-3-[2-[(methylthio)methyl]phenyl]acrolein Formula: C11H12OS MolecularWeight: 192.27738

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=CC=C1C=CC=O

Isomeric SMILES

CSCC1=CC=CC=C1/C=C/C=O

InChI

InChI=1S/C11H12OS/c1-13-9-11-6-3-2-5-10(11)7-4-8-12/h2-8H,9H2,1H3/b7-4+