9-(2,5-dimethylphenyl)sulfanyl-10-oxidanyl-11-oxaspiro[5.5]undec-9-en-8-one

Systemtic Name: 9-(2,5-dimethylphenyl)sulfanyl-10-oxidanyl-11-oxaspiro[5.5]undec-9-en-8-one Openeye Name: 9-(2,5-dimethylphenyl)sulfanyl-10-hydroxy-11-oxaspiro[5.5]undec-9-en-8-one CAS Name: 9-[(2,5-dimethylphenyl)thio]-10-hydroxy-11-oxaspiro[5.5]undec-9-en-8-one IUPAC Name: 9-(2,5-dimethylphenyl)sulfanyl-10-hydroxy-11-oxaspiro[5.5]undec-9-en-8-one Traditional Name: 9-[(2,5-dimethylphenyl)thio]-10-hydroxy-11-oxaspiro[5.5]undec-9-en-8-one Formula: C18H22O3S MolecularWeight: 318.43048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(OC3(CCCCC3)CC2=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(OC3(CCCCC3)CC2=O)O

InChI

InChI=1S/C18H22O3S/c1-12-6-7-13(2)15(10-12)22-16-14(19)11-18(21-17(16)20)8-4-3-5-9-18/h6-7,10,20H,3-5,8-9,11H2,1-2H3