1-(3-methoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one

Systemtic Name: 1-(3-methoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Openeye Name: 1-(3-methoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one CAS Name: 1-(3-methoxyphenyl)-3-(4-methylsulfonylphenyl)-2-propyn-1-one IUPAC Name: 1-(3-methoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Traditional Name: 3-(4-mesylphenyl)-1-(3-methoxyphenyl)prop-2-yn-1-one Formula: C17H14O4S MolecularWeight: 314.35566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C#CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C#CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H14O4S/c1-21-15-5-3-4-14(12-15)17(18)11-8-13-6-9-16(10-7-13)22(2,19)20/h3-7,9-10,12H,1-2H3