ethyl (E,4R,5R)-4-ethylsulfanylcarbonyl-5-oxidanyl-7-phenyl-hept-6-enoate

Systemtic Name: ethyl (E,4R,5R)-4-ethylsulfanylcarbonyl-5-oxidanyl-7-phenyl-hept-6-enoate Openeye Name: ethyl (E,4R,5R)-4-ethylsulfanylcarbonyl-5-hydroxy-7-phenyl-hept-6-enoate CAS Name: (E,4R,5R)-4-[(ethylthio)-oxomethyl]-5-hydroxy-7-phenyl-6-heptenoic acid ethyl ester IUPAC Name: ethyl (E,4R,5R)-4-ethylsulfanylcarbonyl-5-hydroxy-7-phenylhept-6-enoate Traditional Name: (E,4R,5R)-4-(ethylthio)carbonyl-5-hydroxy-7-phenyl-hept-6-enoic acid ethyl ester Formula: C18H24O4S MolecularWeight: 336.44576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(C=CC1=CC=CC=C1)O)C(=O)SCC

Isomeric SMILES

CCOC(=O)CC[C@H]([C@@H](/C=C/C1=CC=CC=C1)O)C(=O)SCC

InChI

InChI=1S/C18H24O4S/c1-3-22-17(20)13-11-15(18(21)23-4-2)16(19)12-10-14-8-6-5-7-9-14/h5-10,12,15-16,19H,3-4,11,13H2,1-2H3/b12-10+/t15-,16-/m1/s1