methyl 3-[(E)-7-ethoxy-7-oxidanylidene-hept-2-enyl]-2-oxidanylidene-4-[(E)-1-phenylsulfanyloct-2-enyl]oxolane-3-carboxylate

Systemtic Name: methyl 3-[(E)-7-ethoxy-7-oxidanylidene-hept-2-enyl]-2-oxidanylidene-4-[(E)-1-phenylsulfanyloct-2-enyl]oxolane-3-carboxylate Openeye Name: methyl 3-[(E)-7-ethoxy-7-oxo-hept-2-enyl]-2-oxo-4-[(E)-1-phenylsulfanyloct-2-enyl]tetrahydrofuran-3-carboxylate CAS Name: 3-[(E)-7-ethoxy-7-oxohept-2-enyl]-2-oxo-4-[(E)-1-(phenylthio)oct-2-enyl]-3-oxolanecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-7-ethoxy-7-oxohept-2-enyl]-2-oxo-4-[(E)-1-phenylsulfanyloct-2-enyl]oxolane-3-carboxylate Traditional Name: 3-[(E)-7-ethoxy-7-keto-hept-2-enyl]-2-keto-4-[(E)-1-(phenylthio)oct-2-enyl]tetrahydrofuran-3-carboxylic acid methyl ester Formula: C29H40O6S MolecularWeight: 516.6893

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(C1COC(=O)C1(CC=CCCCC(=O)OCC)C(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

CCCCC/C=C/C(C1COC(=O)C1(C/C=C/CCCC(=O)OCC)C(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C29H40O6S/c1-4-6-7-8-14-19-25(36-23-17-12-11-13-18-23)24-22-35-28(32)29(24,27(31)33-3)21-16-10-9-15-20-26(30)34-5-2/h10-14,16-19,24-25H,4-9,15,20-22H2,1-3H3/b16-10+,19-14+