1-[2-(ethylsulfanylmethyl)phenyl]hept-6-en-1-one

Systemtic Name: 1-[2-(ethylsulfanylmethyl)phenyl]hept-6-en-1-one Openeye Name: 1-[2-(ethylsulfanylmethyl)phenyl]hept-6-en-1-one CAS Name: 1-[2-[(ethylthio)methyl]phenyl]-6-hepten-1-one IUPAC Name: 1-[2-(ethylsulfanylmethyl)phenyl]hept-6-en-1-one Traditional Name: 1-[2-[(ethylthio)methyl]phenyl]hept-6-en-1-one Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=CC=CC=C1C(=O)CCCCC=C

Isomeric SMILES

CCSCC1=CC=CC=C1C(=O)CCCCC=C

InChI

InChI=1S/C16H22OS/c1-3-5-6-7-12-16(17)15-11-9-8-10-14(15)13-18-4-2/h3,8-11H,1,4-7,12-13H2,2H3