ethyl (E,4S,5S)-4-methyl-4,5-bis(oxidanyl)-7-phenyl-hept-2-enoate

Systemtic Name: ethyl (E,4S,5S)-4-methyl-4,5-bis(oxidanyl)-7-phenyl-hept-2-enoate Openeye Name: ethyl (E,4S,5S)-4,5-dihydroxy-4-methyl-7-phenyl-hept-2-enoate CAS Name: (E,4S,5S)-4,5-dihydroxy-4-methyl-7-phenyl-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E,4S,5S)-4,5-dihydroxy-4-methyl-7-phenylhept-2-enoate Traditional Name: (E,4S,5S)-4,5-dihydroxy-4-methyl-7-phenyl-hept-2-enoic acid ethyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C)(C(CCC1=CC=CC=C1)O)O

Isomeric SMILES

CCOC(=O)/C=C/[C@@](C)([C@H](CCC1=CC=CC=C1)O)O

InChI

InChI=1S/C16H22O4/c1-3-20-15(18)11-12-16(2,19)14(17)10-9-13-7-5-4-6-8-13/h4-8,11-12,14,17,19H,3,9-10H2,1-2H3/b12-11+/t14-,16-/m0/s1