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heptyl 2-methyl-2-oxidanyl-but-3-enoate

heptyl 2-methyl-2-oxidanyl-but-3-enoate

Systemtic Name:heptyl 2-methyl-2-oxidanyl-but-3-enoate
Openeye Name:heptyl 2-hydroxy-2-methyl-but-3-enoate
CAS Name:2-hydroxy-2-methyl-3-butenoic acid heptyl ester
IUPAC Name:heptyl 2-hydroxy-2-methylbut-3-enoate
Traditional Name:2-hydroxy-2-methyl-but-3-enoic acid heptyl ester
Formula: C12H22O3
MolecularWeight: 214.30128
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(C)(C=C)O


Isomeric SMILES

CCCCCCCOC(=O)C(C)(C=C)O


InChI

InChI=1S/C12H22O3/c1-4-6-7-8-9-10-15-11(13)12(3,14)5-2/h5,14H,2,4,6-10H2,1,3H3


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