ethyl 6-cyclohexyl-4-oxidanylidene-1H-isothiochromene-1-carboxylate

Systemtic Name: ethyl 6-cyclohexyl-4-oxidanylidene-1H-isothiochromene-1-carboxylate Openeye Name: ethyl 6-cyclohexyl-4-oxo-isothiochromane-1-carboxylate CAS Name: 6-cyclohexyl-4-oxo-1H-2-benzothiopyran-1-carboxylic acid ethyl ester IUPAC Name: ethyl 6-cyclohexyl-4-oxo-1H-isothiochromene-1-carboxylate Traditional Name: 6-cyclohexyl-4-keto-isothiochroman-1-carboxylic acid ethyl ester Formula: C18H22O3S MolecularWeight: 318.43048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=C(C=C(C=C2)C3CCCCC3)C(=O)CS1

Isomeric SMILES

CCOC(=O)C1C2=C(C=C(C=C2)C3CCCCC3)C(=O)CS1

InChI

InChI=1S/C18H22O3S/c1-2-21-18(20)17-14-9-8-13(12-6-4-3-5-7-12)10-15(14)16(19)11-22-17/h8-10,12,17H,2-7,11H2,1H3