O1'-ethyl O1-methyl 2-oxidanylidene-5-[(E)-1-phenylsulfanyloct-1-enyl]cyclopentane-1,1-dicarboxylate

Systemtic Name: O1'-ethyl O1-methyl 2-oxidanylidene-5-[(E)-1-phenylsulfanyloct-1-enyl]cyclopentane-1,1-dicarboxylate Openeye Name: O1'-ethyl O1-methyl 2-oxo-5-[(E)-1-phenylsulfanyloct-1-enyl]cyclopentane-1,1-dicarboxylate CAS Name: 2-oxo-5-[(E)-1-(phenylthio)oct-1-enyl]cyclopentane-1,1-dicarboxylic acid O1'-ethyl ester O1-methyl ester IUPAC Name: 1-O'-ethyl 1-O-methyl 2-oxo-5-[(E)-1-phenylsulfanyloct-1-enyl]cyclopentane-1,1-dicarboxylate Traditional Name: 2-keto-5-[(E)-1-(phenylthio)oct-1-enyl]cyclopentane-1,1-dicarboxylic acid O1'-ethyl ester O1-methyl ester Formula: C24H32O5S MolecularWeight: 432.57288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=C(C1CCC(=O)C1(C(=O)OC)C(=O)OCC)SC2=CC=CC=C2

Isomeric SMILES

CCCCCC/C=C(\C1CCC(=O)C1(C(=O)OC)C(=O)OCC)/SC2=CC=CC=C2

InChI

InChI=1S/C24H32O5S/c1-4-6-7-8-12-15-20(30-18-13-10-9-11-14-18)19-16-17-21(25)24(19,22(26)28-3)23(27)29-5-2/h9-11,13-15,19H,4-8,12,16-17H2,1-3H3/b20-15+