(E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[4-(methylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[4-(methylthio)phenyl]prop-2-en-1-one Formula: C19H18O3S MolecularWeight: 326.40942

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H18O3S/c1-23-16-7-3-14(4-8-16)5-9-17(20)15-6-10-18-19(13-15)22-12-2-11-21-18/h3-10,13H,2,11-12H2,1H3/b9-5+