(E)-3-(2,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(2,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(2,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(2,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2,5-dimethylphenyl)-1-(4-mesylphenyl)prop-2-en-1-one Formula: C18H18O3S MolecularWeight: 314.39872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H18O3S/c1-13-4-5-14(2)16(12-13)8-11-18(19)15-6-9-17(10-7-15)22(3,20)21/h4-12H,1-3H3/b11-8+