2-(3-chlorophenyl)-3-(4-methylsulfonylphenyl)-4,8-dioxaspiro[4.5]dec-2-en-1-one

Systemtic Name: 2-(3-chlorophenyl)-3-(4-methylsulfonylphenyl)-4,8-dioxaspiro[4.5]dec-2-en-1-one Openeye Name: 2-(3-chlorophenyl)-3-(4-methylsulfonylphenyl)-4,8-dioxaspiro[4.5]dec-2-en-1-one CAS Name: 2-(3-chlorophenyl)-3-(4-methylsulfonylphenyl)-4,8-dioxaspiro[4.5]dec-2-en-1-one IUPAC Name: 2-(3-chlorophenyl)-3-(4-methylsulfonylphenyl)-4,8-dioxaspiro[4.5]dec-2-en-1-one Traditional Name: 2-(3-chlorophenyl)-3-(4-mesylphenyl)-4,8-dioxaspiro[4.5]dec-2-en-1-one Formula: C21H19ClO5S MolecularWeight: 418.89056

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)C3(O2)CCOCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)C3(O2)CCOCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H19ClO5S/c1-28(24,25)17-7-5-14(6-8-17)19-18(15-3-2-4-16(22)13-15)20(23)21(27-19)9-11-26-12-10-21/h2-8,13H,9-12H2,1H3