methyl (E,5R,6R,7S)-5,7-dimethyl-6-oxidanyl-non-3-enoate

Systemtic Name: methyl (E,5R,6R,7S)-5,7-dimethyl-6-oxidanyl-non-3-enoate Openeye Name: methyl (E,5R,6R,7S)-6-hydroxy-5,7-dimethyl-non-3-enoate CAS Name: (E,5R,6R,7S)-6-hydroxy-5,7-dimethyl-3-nonenoic acid methyl ester IUPAC Name: methyl (E,5R,6R,7S)-6-hydroxy-5,7-dimethylnon-3-enoate Traditional Name: (E,5R,6R,7S)-6-hydroxy-5,7-dimethyl-non-3-enoic acid methyl ester Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C)C=CCC(=O)OC)O

Isomeric SMILES

CC[C@H](C)[C@H]([C@H](C)/C=C/CC(=O)OC)O

InChI

InChI=1S/C12H22O3/c1-5-9(2)12(14)10(3)7-6-8-11(13)15-4/h6-7,9-10,12,14H,5,8H2,1-4H3/b7-6+/t9-,10+,12+/m0/s1