1-(3,4-dimethoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Openeye Name: 1-(3,4-dimethoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one CAS Name: 1-(3,4-dimethoxyphenyl)-3-(4-methylsulfonylphenyl)-2-propyn-1-one IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Traditional Name: 1-(3,4-dimethoxyphenyl)-3-(4-mesylphenyl)prop-2-yn-1-one Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O5S/c1-22-17-11-7-14(12-18(17)23-2)16(19)10-6-13-4-8-15(9-5-13)24(3,20)21/h4-5,7-9,11-12H,1-3H3