diethyl 3-oxidanylidene-4-(phenylsulfanylmethyl)cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl 3-oxidanylidene-4-(phenylsulfanylmethyl)cyclopentane-1,1-dicarboxylate Openeye Name: diethyl 3-oxo-4-(phenylsulfanylmethyl)cyclopentane-1,1-dicarboxylate CAS Name: 3-oxo-4-[(phenylthio)methyl]cyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-oxo-4-(phenylsulfanylmethyl)cyclopentane-1,1-dicarboxylate Traditional Name: 3-keto-4-[(phenylthio)methyl]cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C18H22O5S MolecularWeight: 350.42928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(=O)C1)CSC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(C(=O)C1)CSC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H22O5S/c1-3-22-16(20)18(17(21)23-4-2)10-13(15(19)11-18)12-24-14-8-6-5-7-9-14/h5-9,13H,3-4,10-12H2,1-2H3