2,2-diethyl-5-(4-methylsulfonylphenyl)-4-phenyl-furan-3-one

Systemtic Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-phenyl-furan-3-one Openeye Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-phenyl-furan-3-one CAS Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-phenyl-3-furanone IUPAC Name: 2,2-diethyl-5-(4-methylsulfonylphenyl)-4-phenylfuran-3-one Traditional Name: 2,2-diethyl-5-(4-mesylphenyl)-4-phenyl-furan-3-one Formula: C21H22O4S MolecularWeight: 370.46198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3)CC

Isomeric SMILES

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H22O4S/c1-4-21(5-2)20(22)18(15-9-7-6-8-10-15)19(25-21)16-11-13-17(14-12-16)26(3,23)24/h6-14H,4-5H2,1-3H3