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methyl (E,2S,7R)-2,6-dimethyl-4-methylidene-7-oxidanyl-non-5-enoate

methyl (E,2S,7R)-2,6-dimethyl-4-methylidene-7-oxidanyl-non-5-enoate

Systemtic Name:methyl (E,2S,7R)-2,6-dimethyl-4-methylidene-7-oxidanyl-non-5-enoate
Openeye Name:methyl (E,2S,7R)-7-hydroxy-2,6-dimethyl-4-methylene-non-5-enoate
CAS Name:(E,2S,7R)-7-hydroxy-2,6-dimethyl-4-methylene-5-nonenoic acid methyl ester
IUPAC Name:methyl (E,2S,7R)-7-hydroxy-2,6-dimethyl-4-methylidenenon-5-enoate
Traditional Name:(E,2S,7R)-7-hydroxy-2,6-dimethyl-4-methylene-non-5-enoic acid methyl ester
Formula: C13H22O3
MolecularWeight: 226.31198
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H22O3/c1-6-12(14)10(3)7-9(2)8-11(4)13(15)16-5/h7,11-12,14H,2,6,8H2,1,3-5H3/b10-7+/t11-,12+/m0/s1


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