S-octyl (E)-3-phenylprop-2-enethioate

Systemtic Name: S-octyl (E)-3-phenylprop-2-enethioate Openeye Name: S-octyl (E)-3-phenylprop-2-enethioate CAS Name: (E)-3-phenyl-2-propenethioic acid S-octyl ester IUPAC Name: S-octyl (E)-3-phenylprop-2-enethioate Traditional Name: (E)-3-phenylprop-2-enethioic acid S-octyl ester Formula: C17H24OS MolecularWeight: 276.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCSC(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C17H24OS/c1-2-3-4-5-6-10-15-19-17(18)14-13-16-11-8-7-9-12-16/h7-9,11-14H,2-6,10,15H2,1H3/b14-13+