ethyl (E,5S,6S)-6-methyl-5-oxidanyl-7-phenylmethoxy-hept-2-enoate

Systemtic Name: ethyl (E,5S,6S)-6-methyl-5-oxidanyl-7-phenylmethoxy-hept-2-enoate Openeye Name: ethyl (E,5S,6S)-7-benzyloxy-5-hydroxy-6-methyl-hept-2-enoate CAS Name: (E,5S,6S)-5-hydroxy-6-methyl-7-phenylmethoxy-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E,5S,6S)-5-hydroxy-6-methyl-7-phenylmethoxyhept-2-enoate Traditional Name: (E,5S,6S)-7-benzoxy-5-hydroxy-6-methyl-hept-2-enoic acid ethyl ester Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC(C(C)COCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)/C=C/C[C@@H]([C@@H](C)COCC1=CC=CC=C1)O

InChI

InChI=1S/C17H24O4/c1-3-21-17(19)11-7-10-16(18)14(2)12-20-13-15-8-5-4-6-9-15/h4-9,11,14,16,18H,3,10,12-13H2,1-2H3/b11-7+/t14-,16-/m0/s1