5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-(4-prop-1-ynylphenyl)furan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-(4-prop-1-ynylphenyl)furan-2-one Openeye Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-(4-prop-1-ynylphenyl)furan-2-one CAS Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-(4-prop-1-ynylphenyl)-2-furanone IUPAC Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-(4-prop-1-ynylphenyl)furan-2-one Traditional Name: 4-(4-mesylphenyl)-5,5-dimethyl-3-(4-prop-1-ynylphenyl)furan-2-one Formula: C22H20O4S MolecularWeight: 380.4568

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC=C(C=C1)C2=C(C(OC2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC#CC1=CC=C(C=C1)C2=C(C(OC2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H20O4S/c1-5-6-15-7-9-16(10-8-15)19-20(22(2,3)26-21(19)23)17-11-13-18(14-12-17)27(4,24)25/h7-14H,1-4H3