ethyl 2-(5-oxidanyl-4-oxidanylidene-spiro[3H-thiochromene-2,1'-cyclohexane]-7-yl)oxyethanoate

Systemtic Name: ethyl 2-(5-oxidanyl-4-oxidanylidene-spiro[3H-thiochromene-2,1'-cyclohexane]-7-yl)oxyethanoate Openeye Name: ethyl 2-(5'-hydroxy-4'-oxo-spiro[cyclohexane-1,2'-thiochromane]-7'-yl)oxyacetate CAS Name: 2-[(5-hydroxy-4-oxo-7-spiro[3H-1-benzothiopyran-2,1'-cyclohexane]yl)oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-(5-hydroxy-4-oxospiro[3H-thiochromene-2,1'-cyclohexane]-7-yl)oxyacetate Traditional Name: 2-(5'-hydroxy-4'-keto-spiro[cyclohexane-1,2'-thiochroman]-7'-yl)oxyacetic acid ethyl ester Formula: C18H22O5S MolecularWeight: 350.42928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC(=C2C(=O)CC3(CCCCC3)SC2=C1)O

Isomeric SMILES

CCOC(=O)COC1=CC(=C2C(=O)CC3(CCCCC3)SC2=C1)O

InChI

InChI=1S/C18H22O5S/c1-2-22-16(21)11-23-12-8-13(19)17-14(20)10-18(24-15(17)9-12)6-4-3-5-7-18/h8-9,19H,2-7,10-11H2,1H3