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

Systemtic Name: 7-(3-chloranyl-4-ethanoyl-phenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one Openeye Name: 7-(4-acetyl-3-chloro-phenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one CAS Name: 7-(4-acetyl-3-chlorophenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one IUPAC Name: 7-(4-acetyl-3-chlorophenyl)-8-(4-methylsulfonylphenyl)-9-oxaspiro[4.4]non-7-en-6-one Traditional Name: 7-(4-acetyl-3-chloro-phenyl)-8-(4-mesylphenyl)-9-oxaspiro[4.4]non-7-en-6-one Formula: C23H21ClO5S MolecularWeight: 444.92784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClO5S/c1-14(25)18-10-7-16(13-19(18)24)20-21(29-23(22(20)26)11-3-4-12-23)15-5-8-17(9-6-15)30(2,27)28/h5-10,13H,3-4,11-12H2,1-2H3