ethyl 2-[(Z,2S,5R)-4-methyl-7-oxidanylidene-7-phenyl-5-phenylmethoxy-hept-3-en-2-yl]sulfonylethanoate

Systemtic Name: ethyl 2-[(Z,2S,5R)-4-methyl-7-oxidanylidene-7-phenyl-5-phenylmethoxy-hept-3-en-2-yl]sulfonylethanoate Openeye Name: ethyl 2-[(Z,1S,4R)-4-benzyloxy-1,3-dimethyl-6-oxo-6-phenyl-hex-2-enyl]sulfonylacetate CAS Name: 2-[(Z,2S,5R)-4-methyl-7-oxo-7-phenyl-5-phenylmethoxyhept-3-en-2-yl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[(Z,2S,5R)-4-methyl-7-oxo-7-phenyl-5-phenylmethoxyhept-3-en-2-yl]sulfonylacetate Traditional Name: 2-[(Z,1S,4R)-4-benzoxy-6-keto-1,3-dimethyl-6-phenyl-hex-2-enyl]sulfonylacetic acid ethyl ester Formula: C25H30O6S MolecularWeight: 458.5671

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C(C)C=C(C)C(CC(=O)C1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CS(=O)(=O)[C@@H](C)/C=C(/C)\[C@@H](CC(=O)C1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C25H30O6S/c1-4-30-25(27)18-32(28,29)20(3)15-19(2)24(31-17-21-11-7-5-8-12-21)16-23(26)22-13-9-6-10-14-22/h5-15,20,24H,4,16-18H2,1-3H3/b19-15-/t20-,24+/m0/s1