7-(3-methylphenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one

Systemtic Name: 7-(3-methylphenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one Openeye Name: 8-(4-methylsulfonylphenyl)-7-(m-tolyl)-9-oxaspiro[4.4]non-7-en-6-one CAS Name: 7-(3-methylphenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one IUPAC Name: 7-(3-methylphenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one Traditional Name: 8-(4-mesylphenyl)-7-(m-tolyl)-9-oxaspiro[4.4]non-7-en-6-one Formula: C22H22O4S MolecularWeight: 382.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(OC3(C2=O)CCCC3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(OC3(C2=O)CCCC3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H22O4S/c1-15-6-5-7-17(14-15)19-20(26-22(21(19)23)12-3-4-13-22)16-8-10-18(11-9-16)27(2,24)25/h5-11,14H,3-4,12-13H2,1-2H3