ethyl (2S,3R)-2-methyl-3-prop-1-en-2-yl-hexanoate

Systemtic Name: ethyl (2S,3R)-2-methyl-3-prop-1-en-2-yl-hexanoate Openeye Name: ethyl (2S,3R)-3-isopropenyl-2-methyl-hexanoate CAS Name: (2S,3R)-2-methyl-3-(1-methylethenyl)hexanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-methyl-3-prop-1-en-2-ylhexanoate Traditional Name: (2S,3R)-2,4-dimethyl-3-propyl-pent-4-enoic acid ethyl ester Formula: C12H22O2 MolecularWeight: 198.30188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)C(=O)OCC)C(=C)C

Isomeric SMILES

CCC[C@H]([C@H](C)C(=O)OCC)C(=C)C

InChI

InChI=1S/C12H22O2/c1-6-8-11(9(3)4)10(5)12(13)14-7-2/h10-11H,3,6-8H2,1-2,4-5H3/t10-,11-/m0/s1